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 for designing and evaluating ADC constructs.

PROTAC

2,814

PROTAC and targeted protein degradation tools for discovery research. Browse degrader-related ligands, linkers, and building blocks 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. 4,5-Dimethyl-3-(2-oxo-2-phenylethyl)thiazol-3-ium chloride
    CAS: 341028-37-3 Formula: C13H14ClNOS Molecular Weight: 267.77
    ● In Stock — US Item #: D192843
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    Technical Identifiers
    IUPAC Name
    2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)-1-phenylethanone;chloride
    SMILES
    CC1=C(SC=[N+]1CC(=O)C2=CC=CC=C2)C.[Cl-]
    InChIKey
    MKOMESMZHZNBIZ-UHFFFAOYSA-M
    InChI
    1S/C13H14NOS.ClH/c1-10-11(2)16-9-14(10)8-13(15)12-6-4-3-5-7-12;/h3-7,9H,8H2,1-2H3;1H/q+1;/p-1
    Synonyms
    SMR004701797 | ALAGEBRIUM CHLORIDE [INN] | SCHEMBL33828 | AKOS016009967 | THIAZOLIUM, 4,5-DIMETHYL-3-(2-OXO-2-PHENYLE...
  2. 16,16-dimethyl Prostaglandin F2β
    CAS: 59769-89-0 PubChem CID: 5283082 Formula: C22H38O5 Molecular Weight: 382.5
    ≥96% ~10mg/2ml in methyl acetate
    ● In Stock — US Item #: D355706
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    IUPAC Name
    (Z)-7-[(1R,2R,3R,5R)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]cyclopentyl]hept-5-enoic acid
    SMILES
    CCCCC(C)(C)C(C=CC1C(CC(C1CC=CCCCC(=O)O)O)O)O
    InChIKey
    YMRWVEHSLXJOCD-OPVFONCOSA-N
    InChI
    1S/C22H38O5/c1-4-5-14-22(2,3)20(25)13-12-17-16(18(23)15-19(17)24)10-8-6-7-9-11-21(26)27/h6,8,12-13,16-20,23-25H,4-5,7,9-11,14-15H2,1-3H3,(H,26,27)/b8-show more
    Synonyms
    9β,11α,15R-trihydroxy-16,16-dimethyl-prosta-5Z,13E-dien-1-oic acid | 9β,16,16-dimethyl PGF2α | 16,16-dimethyl PGF2β
  3. rac-Acolbifene
    CAS: 151533-34-5 Formula: C29H31NO4 Molecular Weight: 457.56
    ◐ .Made to order · 8–12 wks Item #: R340210
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    IUPAC Name
    3-(4-hydroxyphenyl)-4-methyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2H-chromen-7-ol
    SMILES
    CC1=C(C(OC2=C1C=CC(=C2)O)C3=CC=C(C=C3)OCCN4CCCCC4)C5=CC=C(C=C5)O
    InChIKey
    DUYNJNWVGIWJRI-UHFFFAOYSA-N
    InChI
    1S/C29H31NO4/c1-20-26-14-11-24(32)19-27(26)34-29(28(20)21-5-9-23(31)10-6-21)22-7-12-25(13-8-22)33-18-17-30-15-3-2-4-16-30/h5-14,19,29,31-32H,2-4,15-18show more
    Synonyms
    3-(4-Hydroxyphenyl)-4-methyl-2-[4-[2-(1-piperidinyl)ethoxy]phenyl]-2H-1-benzopyran-7-ol | EM 343
  4. (6R,7R)-7-Amino-3-Hydroxymethyl-8-Oxo-5-Thia-1-Aza-Bicyclo[4.2.0.]Oct-2-Ene-2-Carboxylic Acid
    CAS: 15690-38-7 PubChem CID: 11031679 Formula: C8H10N2O4S Molecular Weight: 230.24
    ● In Stock — US Item #: R303007
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    Technical Identifiers
    IUPAC Name
    (6R,7R)-7-amino-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
    SMILES
    C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)CO
    InChIKey
    BQIMPGFMMOZASS-CLZZGJSISA-N
    InChI
    1S/C8H10N2O4S/c9-4-6(12)10-5(8(13)14)3(1-11)2-15-7(4)10/h4,7,11H,1-2,9H2,(H,13,14)/t4-,7-/m1/s1
    Synonyms
    SCHEMBL3244823 | BQIMPGFMMOZASS-CLZZGJSISA-N | Hydroxymethyl-7-aminocephalosporanic acid | MFCD09751258 | 57NLN1Y39I ...
  5. Pitstop 2-100,clathrin terminal domain inhibitor
    CAS: 1621425-18-0 Formula: C20H12Cl2N2O3S2 Molecular Weight: 463.35
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%(mixture of isomers)
    ● In Stock — US Item #: P275703
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    Technical Identifiers
    Synonyms
    (Z)-N-[5-(3,5-Dichlorobenzylidene)-4-oxo-4,5-dihydrothiazol-2-yl]naphthalene-1-sulfonamide | (Z)-N-[5-(3,5-Dichlorobe...
  6. AM 1172
    CAS: 251908-92-6 PubChem CID: 10364179 Formula: C27H39NO2 Molecular Weight: 409.6
    ◐ .Made to order · 8–12 wks Item #: A287204
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    IUPAC Name
    4-hydroxy-N-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenyl]benzamide
    SMILES
    CCCCCC=CCC=CCC=CCC=CCCCCNC(=O)C1=CC=C(C=C1)O
    InChIKey
    XCWBOAHOJHPWLA-DOFZRALJSA-N
    InChI
    1S/C27H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-28-27(30)25-20-22-26(29)23-21-25/h6-7,9-10,12-13,15-16,20-23,29H,2-5,8,11,14,17-19,24show more
    Synonyms
    SCHEMBL14105462 | N-arachidonyl 4-hydroxybenzamide | UNII-G5DZB59PZA | AM1172 | AM-1172 | AM2201-d5 | BA168613 | SR-0...
  7. PEN (human)
    CAS: 597578-70-6 PubChem CID: 16139549 Formula: C₉₇H₁₅₉N₂₇O₃₂ Molecular Weight: 2215.49
    ◐ .Made to order · 8–12 wks Item #: P288202
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    Technical Identifiers
    SMILES
    [H]N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC1=CNC=N1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cshow more
    InChIKey
    PEIJMGIGWZOADR-UCVVRVGMSA-N
    Synonyms
    pro-SAAS (221-242)
  8. (2S)-4-Oxo-2-(3-thiazolidinylcarbonyl)-1-pyrrolidinecarboxylic acid tert-butyl ester
    CAS: 401564-36-1 EC Number: 813-401-8 PubChem CID: 58516805 Formula: C13H20N2O4S Molecular Weight: 300.37
    Solid ≥98%
    ● In Stock — US Item #: S303654
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    IUPAC Name
    tert-butyl (2S)-4-oxo-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate
    SMILES
    CC(C)(C)OC(=O)N1CC(=O)CC1C(=O)N2CCSC2
    InChIKey
    ULXKZRPRLJGLDM-JTQLQIEISA-N
    InChI
    1S/C13H20N2O4S/c1-13(2,3)19-12(18)15-7-9(16)6-10(15)11(17)14-4-5-20-8-14/h10H,4-8H2,1-3H3/t10-/m0/s1
    Synonyms
    1-Pyrrolidinecarboxylic acid,4-oxo-2-(3-thiazolidinylcarbonyl)-,1,1-diMethylethyl ester,(2S)- | tert-butyl (S)-4-oxo-...
  9. (2S,3S,4E)-2-aminooctadec-4-ene-1,3-diol
    CAS: 25695-95-8 Formula: C18H37NO2 Molecular Weight: 299.492
    ◐ .Made to order · 8–12 wks Item #: S130603
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    Technical Identifiers
    IUPAC Name
    (E,2S,3S)-2-aminooctadec-4-ene-1,3-diol
    SMILES
    CCCCCCCCCCCCCC=CC(C(CO)N)O
    InChIKey
    WWUZIQQURGPMPG-DNWQSSKHSA-N
    InChI
    1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18-/m0/s1
    Synonyms
    4-Octadecene-1,3-diol, 2-amino-, (S-(R*,R*-(E)))- | AKOS027276431 | L-threo-Sphingosine C-18 | 4-Octadecene-1,3-diol,...
  10. 10-Cl-BBQ
    CAS: 23982-76-5 Formula: C18H9ClN2O Molecular Weight: 304.73
    ● In Stock — US Item #: C286919
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    Technical Identifiers
    IUPAC Name
    7-chloro-3,10-diazapentacyclo[10.7.1.02,10.04,9.016,20]icosa-1(19),2,4(9),5,7,12,14,16(20),17-nonaen-11-one
    SMILES
    C1=CC2=C3C(=C1)C4=NC5=C(N4C(=O)C3=CC=C2)C=C(C=C5)Cl
    InChIKey
    ZJESJVGSDQOZAT-UHFFFAOYSA-N
    InChI
    1S/C18H9ClN2O/c19-11-7-8-14-15(9-11)21-17(20-14)12-5-1-3-10-4-2-6-13(16(10)12)18(21)22/h1-9H
    Synonyms
    10-Chloro-7H-benzimidazo[2,1-a]benz[de]isoquinolin-7-one | 10ClBBQ
  11. 4-Biphenylacetic Acid
    CAS: 5728-52-9 EC Number: 227-233-2 Formula: C14H12O2 Molecular Weight: 212.25
    Solid ≥98%(HPLC)
    ● In Stock — US Item #: B152460
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    Technical Identifiers
    IUPAC Name
    2-(4-phenylphenyl)acetic acid
    SMILES
    C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)O
    InChIKey
    QRZAKQDHEVVFRX-UHFFFAOYSA-N
    InChI
    1S/C14H12O2/c15-14(16)10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10H2,(H,15,16)
    Synonyms
    4-Carboxymethylbiphenyl | Acetic acid, (4-biphenylyl)- | FELBINAC [MI] | Opera_ID_534 | SMR000059071 | AR1730 | HFN-3...
  12. p-MPPI monohydrochloride
    CAS: 220643-77-6 PubChem CID: 11957651 Formula: C25H27IN4O2•HCl Molecular Weight: 542.413646
    ◐ .Made to order · 8–12 wks Item #: P335712
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    Technical Identifiers
    IUPAC Name
    4-iodo-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-N-pyridin-2-ylbenzamide;hydrochloride
    SMILES
    COC1=CC=CC=C1N2CCN(CC2)CCN(C3=CC=CC=N3)C(=O)C4=CC=C(C=C4)I.Cl
    InChIKey
    PBPBIDMIRMWUCI-UHFFFAOYSA-N
    InChI
    1S/C25H27IN4O2.ClH/c1-32-23-7-3-2-6-22(23)29-17-14-28(15-18-29)16-19-30(24-8-4-5-13-27-24)25(31)20-9-11-21(26)12-10-20;/h2-13H,14-19H2,1H3;1H
    Synonyms
    PD021140 | 4-Iodo-N-[2-[4-(methoxyphenyl)-1-piperazinyl]ethyl]-N-(2-pyridinyl)benzamide monohydrochloride | 4-Iodo-N-...
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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.
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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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