Targets & Pathways

Explore small molecules, screening libraries, and tool compounds for discovery research. Browse by target, pathway, or ligand family to quickly find inhibitors, agonists, and chemical probes, with searchable structure/CAS data and supporting documents (SDS/COA where available).

136,943 products

Ready-to-screen compound libraries and focused sets for hit discovery. Browse libraries by target class, pathway, scaffold, or application, and review size, format, and compound information to build screening panels.Customize Your Screening Library to choose compounds, format, and volume, and we’ll prepare a ready-to-use set for you.Customize Your Screening Library

Navigate small molecules by ligand family or scaffold to build focused sets and explore structure–activity relationships. This category groups related chemotypes, helping you select analogs, fragments, and tool molecules for discovery research.

ADC-focused building blocks and tools to support antibody–drug conjugate research. Explore payloads, linkers, conjugation reagents, and related small-molecule components (where available) for designing and evaluating ADC constructs.

PROTAC

2,815

PROTAC and targeted protein degradation tools for discovery research. Browse degrader-related ligands, linkers, and building blocks (where available) to assemble or screen PROTAC designs, with clear identifiers for efficient selection.

Explore pathway-focused tool compounds to study and modulate key signaling cascades. Browse small molecules grouped by signaling pathway to support mechanism studies, phenotypic assays, and target validation, with clear identifiers for fast searching.

Find bioactive small molecules organized by protein target (DTO). Quickly locate tool compounds for specific targets and compare identifiers such as structure, CAS, and synonyms—plus supporting documents —to build screening and validation sets.

Shop small molecules and tool compounds organized by disease area (DOID). Discover chemical probes, libraries, and related products mapped to therapeutic areas to help assemble compound sets for screening, pathway exploration, and model studies.

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  1. Piceatannol
    CAS: 10083-24-6 EC Number: 600-132-4 Formula: C14H12O4 Molecular Weight: 244.25
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: P580488
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    Technical Identifiers
    IUPAC Name
    4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]benzene-1,2-diol
    SMILES
    C1=CC(=C(C=C1C=CC2=CC(=CC(=C2)O)O)O)O
    InChIKey
    CDRPUGZCRXZLFL-OWOJBTEDSA-N
    InChI
    1S/C14H12O4/c15-11-5-10(6-12(16)8-11)2-1-9-3-4-13(17)14(18)7-9/h1-8,15-18H/b2-1+
    Synonyms
    3,3',4,5'-Tetrahydroxy-trans-stilbene | cid_667639 | K00089 | MLS003171221 | piceatannol | SW219501-1 | 1, 4-[2-(3,5-...
  2. Pifithrin-μ
    CAS: 64984-31-2 EC Number: 636-240-3 Formula: C8H7NO2S Molecular Weight: 181.212
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P580489
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    IUPAC Name
    2-phenylethynesulfonamide
    SMILES
    C1=CC=C(C=C1)C#CS(=O)(=O)N
    InChIKey
    ZZUZYEMRHCMVTB-UHFFFAOYSA-N
    InChI
    1S/C8H7NO2S/c9-12(10,11)7-6-8-4-2-1-3-5-8/h1-5H,(H2,9,10,11)
    Synonyms
    HMS3677N19 | Q27165400 | HMS3263J21 | Pifithrin-.mu. | Tox21_501170 | 2-phenylacetylenesulfonamide | Pifithrin-mu - C...
  3. Pleconaril, VP1 capsid protein disrupting agent
    CAS: 153168-05-9 EC Number: 683-423-9 PubChem CID: 1684 Formula: C18H18F3N3O3 Molecular Weight: 381.35
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P580491
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    IUPAC Name
    3-[3,5-dimethyl-4-[3-(3-methyl-1,2-oxazol-5-yl)propoxy]phenyl]-5-(trifluoromethyl)-1,2,4-oxadiazole
    SMILES
    CC1=CC(=CC(=C1OCCCC2=CC(=NO2)C)C)C3=NOC(=N3)C(F)(F)F
    InChIKey
    KQOXLKOJHVFTRN-UHFFFAOYSA-N
    InChI
    1S/C18H18F3N3O3/c1-10-7-13(16-22-17(27-24-16)18(19,20)21)8-11(2)15(10)25-6-4-5-14-9-12(3)23-26-14/h7-9H,4-6H2,1-3H3
    Synonyms
    BDBM50111469 | UNII-9H4570Q89D | 3-{3,5-dimethyl-4-[3-(3-methylisoxazol-5-yl)propoxy]phenyl}-5-(trifluoromethyl)-1,2,...
  4. Pluripotin
    CAS: 839707-37-8 EC Number: 804-647-7 PubChem CID: 12003241 Formula: C27H25F3N8O2 Molecular Weight: 550.54
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: P580492
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    IUPAC Name
    N-[3-[7-[(2,5-dimethylpyrazol-3-yl)amino]-1-methyl-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl]-4-methylphenyl]-3-(trifluoromethyl)benzamide
    SMILES
    CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)N3CC4=CN=C(N=C4N(C3=O)C)NC5=CC(=NN5C)C
    InChIKey
    NBZFRTJWEIHFPF-UHFFFAOYSA-N
    InChI
    1S/C27H25F3N8O2/c1-15-8-9-20(32-24(39)17-6-5-7-19(11-17)27(28,29)30)12-21(15)38-14-18-13-31-25(34-23(18)36(3)26(38)40)33-22-10-16(2)35-37(22)4/h5-13H,show more
    Synonyms
    HY-10579 | A915250 | N-[3-[7-(2,5-Dimethyl-2H-pyrazol-3-ylamino)-1-methyl-2-oxo-1,4-dihydro-2H-pyrimido[4,5-d]pyrimid...
  5. Procyclidine Hydrochloride, Muscarinic acetylcholine receptor M1 antagonist
    CAS: 1508-76-5 EC Number: 216-141-8 Formula: C19H29NO · HCl Molecular Weight: 323.9
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: P580496
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    IUPAC Name
    1-cyclohexyl-1-phenyl-3-pyrrolidin-1-ylpropan-1-ol;hydrochloride
    SMILES
    C1CCC(CC1)C(CCN2CCCC2)(C3=CC=CC=C3)O.Cl
    InChIKey
    ZFSPFXJSEHCTTR-UHFFFAOYSA-N
    InChI
    1S/C19H29NO.ClH/c21-19(17-9-3-1-4-10-17,18-11-5-2-6-12-18)13-16-20-14-7-8-15-20;/h1,3-4,9-10,18,21H,2,5-8,11-16H2;1H
    Synonyms
    (+-)-Procyclidine hydrochloride | Procyclidine hydrochloride, United States Pharmacopeia (USP) Reference Standard | P...
  6. Promazine Hydrochloride, Serotonin 2a (5-HT2a) receptor antagonist
    CAS: 53-60-1 EC Number: 200-179-7 Formula: C17H20N2S · HCl Molecular Weight: 320.88
    Liquid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: P580497
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    IUPAC Name
    N,N-dimethyl-3-phenothiazin-10-ylpropan-1-amine;hydrochloride
    SMILES
    CN(C)CCCN1C2=CC=CC=C2SC3=CC=CC=C31.Cl
    InChIKey
    JIVSXRLRGOICGA-UHFFFAOYSA-N
    InChI
    1S/C17H20N2S.ClH/c1-18(2)12-7-13-19-14-8-3-5-10-16(14)20-17-11-6-4-9-15(17)19;/h3-6,8-11H,7,12-13H2,1-2H3;1H
    Synonyms
    Verofen | 10-[3-(Dimethylamino)propyl]phenothiazine hydrochloride | 10H-Phenothiazine-10-propanamine, N,N-dimethyl-,m...
  7. Phlogopite
    CAS: 12001-26-2 EC Number: 601-648-2 Formula: K2O.3Al2O3.6SiO2∙2H2O Molecular Weight: 796.65(760.62anhy)
    Technical grade ? Technical grade — industrial-quality purity with no tight impurity guarantees. Use for large-scale or non-critical processes where cost matters most. 200 mesh
    ● In Stock — US warehouse, ships to EU* Item #: P580753
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    IUPAC Name
    dipotassium;dioxosilane;oxo(oxoalumanyloxy)alumane;oxygen(2-)
    SMILES
    [O-2].O=[Al]O[Al]=O.O=[Si]=O.[K+].[K+]
    InChIKey
    YGANSGVIUGARFR-UHFFFAOYSA-N
    InChI
    1S/2Al.2K.O2Si.4O/c;;;;1-3-2;;;;/q;;2*+1;;;;;-2
    Synonyms
    Muscovite|12001-26-2|Chacaltaite|Astrolit|Astrolite|Cogemika|Serikuron|Fluorian muscovite|Muscovite, fluorian|Clarite...
  8. DAPTA TFA
    CAS: 106362-34-9 PubChem CID: 184644 Formula: C35H56N10O15xC2HF3O2 Molecular Weight: 856.9(free base)
    Liquid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in Water
    ◐ .Made to order · 8–12 wks Item #: P580562
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    IUPAC Name
    (2S)-N-[(2S)-1-[[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-2-[[(2S,3R)-2-[[(2S,3R)-2-[[(2S,3R)-2-[[(2S)-2show more
    SMILES
    CC(C(C(=O)N)NC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C(CC(=O)N)NC(=O)C(C(C)O)NC(=O)C(C(C)O)NC(=O)C(C(C)O)NC(=O)C(CO)NC(=O)C(C)N)O
    InChIKey
    AKWRNBWMGFUAMF-ZESMOPTKSA-N
    InChI
    1S/C35H56N10O15/c1-13(36)29(54)41-22(12-46)32(57)43-26(16(4)49)34(59)45-27(17(5)50)35(60)44-25(15(3)48)33(58)40-21(11-23(37)52)30(55)39-20(10-18-6-8-1show more
    Synonyms
    DAPTA(TFA) | SCHEMBL7706935 | AKOS024457091 | AS-58148 | AC-31499 | D-Ala-Ser-Thr-Thr-Thr-Asn-Tyr-Thr-NH2 | NCGC00599...
  9. Protopine
    CAS: 130-86-9 EC Number: 204-999-6 Formula: C20H19NO5 Molecular Weight: 353.37
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P580498
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    IUPAC Name
    15-methyl-7,9,19,21-tetraoxa-15-azapentacyclo[15.7.0.04,12.06,10.018,22]tetracosa-1(17),4,6(10),11,18(22),23-hexaen-3-one
    SMILES
    CN1CCC2=CC3=C(C=C2C(=O)CC4=C(C1)C5=C(C=C4)OCO5)OCO3
    InChIKey
    GPTFURBXHJWNHR-UHFFFAOYSA-N
    InChI
    1S/C20H19NO5/c1-21-5-4-13-7-18-19(25-10-24-18)8-14(13)16(22)6-12-2-3-17-20(15(12)9-21)26-11-23-17/h2-3,7-8H,4-6,9-11H2,1H3
    Synonyms
    7,13a-Secoberbin-13a-one, 7-methyl-2,3:9,10-bis(methylenedioxy)- | AI3-62909 | P2611 | ACon1_001550 | MFCD00022322 | ...
  10. Prucalopride succinate, Serotonin 4 (5-HT4) receptor agonist
    CAS: 179474-85-2 EC Number: 680-639-5 PubChem CID: 9870009 Formula: C18H26ClN3O3·C4H6O4 Molecular Weight: 485.96
    Liquid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P580499
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    IUPAC Name
    4-amino-5-chloro-N-[1-(3-methoxypropyl)piperidin-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;butanedioic acid
    SMILES
    COCCCN1CCC(CC1)NC(=O)C2=CC(=C(C3=C2OCC3)N)Cl.C(CC(=O)O)C(=O)O
    InChIKey
    QZRSNVSQLGRAID-UHFFFAOYSA-N
    InChI
    1S/C18H26ClN3O3.C4H6O4/c1-24-9-2-6-22-7-3-12(4-8-22)21-18(23)14-11-15(19)16(20)13-5-10-25-17(13)14;5-3(6)1-2-4(7)8/h11-12H,2-10,20H2,1H3,(H,21,23);1-2show more
    Synonyms
    R-108512 | Prucalopride Succinat | BUTANEDIOIC ACID 4-AMINO-5-CHLORO-2,3-DIHYDRO-N-[1-(3-METHOXYPROPYL)-4-PIPERIDINYL...
  11. (R)-Atenolol
    CAS: 56715-13-0 Formula: C14H22N2O3 Molecular Weight: 266.34
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
    ● In Stock — US warehouse, ships to EU* Item #: R136197
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    IUPAC Name
    2-[4-[(2R)-2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide
    SMILES
    CC(C)NCC(COC1=CC=C(C=C1)CC(=O)N)O
    InChIKey
    METKIMKYRPQLGS-GFCCVEGCSA-N
    InChI
    1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)/t12-/m1/s1
    Synonyms
    (+)-(R)-Atenolol | MLS001332497 | Lopac0_000146 | Prestwick0_000953 | (R)-2-(4-(2-Hydroxy-3-(isopropylamino)propoxy)p...
  12. Rhapontin
    CAS: 155-58-8 EC Number: 205-845-0 PubChem CID: 637213 Formula: C21H24O9 Molecular Weight: 420.41
    ● In Stock — US warehouse, ships to EU* Item #: R138298
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    IUPAC Name
    (2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
    SMILES
    COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O)O)O
    InChIKey
    GKAJCVFOJGXVIA-DXKBKAGUSA-N
    InChI
    1S/C21H24O9/c1-28-16-5-4-11(8-15(16)24)2-3-12-6-13(23)9-14(7-12)29-21-20(27)19(26)18(25)17(10-22)30-21/h2-9,17-27H,10H2,1H3/b3-2+/t17-,18-,19+,20-,21-show more
    Synonyms
    BSPBio_002946 | MFCD00010117 | N,N-Bis(trimethylsilyl)-1,4-butanediamine | Spectrum5_001757 | CHEBI:92176 | (2S,3R,4S...
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Frequently Asked Questions

What does the By Target/Pathway/Disease listing cover?
It groups compounds associated with targets in By Target/Pathway/Disease, organised so you can move from the pathway to an individual target and then to a specific chemotype. Each entry carries structure, CAS number, and reported activity.
How is By Target/Pathway/Disease organised?
By Target/Pathway/Disease is broken down into Compound Libraries, PROTACs, molecular glues and other degraders and Antibody-drug Conjugates(ADC). Compounds acting on more than one node appear under each relevant target.
How do I choose compounds for By Target/Pathway/Disease research?
For By Target/Pathway/Disease, pick a well-characterised reference compound for the node you want to perturb, and pair it with a structurally unrelated compound hitting the same target — that is the cleanest way to separate pathway effects from off-target ones. Check potency, selectivity, and cell permeability against your assay format. All products are supplied for professional research and development use only, and are not for use in humans, animals, diagnostics, or therapy.
How do I find a specific compound within By Target/Pathway/Disease?
Search By Target/Pathway/Disease by compound name, CAS number, or SMILES, or drill down through the target listing. Unlisted compounds and bulk quantities: [email protected]. We supply verified businesses, research institutions, universities, and government agencies.

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