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).

136,942 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

2,814

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. Porcn-IN-1
    CAS: 2036044-77-4 PubChem CID: 132578555 Formula: C25H19FN4O Molecular Weight: 410.44
    ● In Stock — US warehouse, ships to EU* Item #: P412192
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    Technical Identifiers
    IUPAC Name
    N-[[5-fluoro-6-(2-methylpyridin-4-yl)pyridin-3-yl]methyl]-9H-carbazole-2-carboxamide
    SMILES
    CC1=NC=CC(=C1)C2=C(C=C(C=N2)CNC(=O)C3=CC4=C(C=C3)C5=CC=CC=C5N4)F
    InChIKey
    GOMFFTZBKYVUOE-UHFFFAOYSA-N
    InChI
    1S/C25H19FN4O/c1-15-10-17(8-9-27-15)24-21(26)11-16(13-28-24)14-29-25(31)18-6-7-20-19-4-2-3-5-22(19)30-23(20)12-18/h2-13,30H,14H2,1H3,(H,29,31)
    Synonyms
    MDK-4774 | MDK-4774 free base
  2. Porfiromycin
    CAS: 801-52-5 PubChem CID: 13116 Formula: C16H20N4O5 Molecular Weight: 348.35
    ◐ .Made to order · 8–12 wks Item #: P343274
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    Technical Identifiers
    IUPAC Name
    [(4S,6S,7R,8S)-11-amino-7-methoxy-5,12-dimethyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate
    SMILES
    CC1=C(C(=O)C2=C(C1=O)N3CC4C(C3(C2COC(=O)N)OC)N4C)N
    InChIKey
    HRHKSTOGXBBQCB-VFWICMBZSA-N
    InChI
    1S/C16H20N4O5/c1-6-10(17)13(22)9-7(5-25-15(18)23)16(24-3)14-8(19(14)2)4-20(16)11(9)12(6)21/h7-8,14H,4-5,17H2,1-3H3,(H2,18,23)/t7-,8+,14+,16-,19?/m1/s1
    Synonyms
    PORFIROMYCIN [INN] | D05572 | Porfiromycin [USAN:INN:BAN] | AI3-50825 | Azirino(2',3':3,4)pyrrolo(1,2-a)-indole-4,7-d...
  3. 3-Dehydrotrametenolic acid
    CAS: 29220-16-4 PubChem CID: 15391340 Formula: C30H46O3 Molecular Weight: 454.7
    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%
    ◐ .Made to order · 8–12 wks Item #: P412638
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    IUPAC Name
    (2R)-2-[(3S,5R,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoshow more
    SMILES
    CC(=CCCC(C1CCC2(C1(CC=C3C2=CCC4C3(CCC(C4(C)C)O)C)C)C)C(=O)O)C
    InChIKey
    QFPLAAZRZNKRRY-GIICLEHTSA-N
    InChI
    1S/C30H46O3/c1-19(2)9-8-10-20(26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h9,11,14,20-21,24-25,31H,8,10,12-13show more
    Synonyms
    3-Dehydrotrametenolic acid | Dehydrotrametenolic acid
  4. Potassium (t-butylaminomethyl)trifluoroborate
    CAS: 1256366-05-8 PubChem CID: 45588138 Formula: C5H12BF3KN Molecular Weight: 193.06
    ◐ .Made to order · 8–12 wks Item #: P302303
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    IUPAC Name
    potassium;(tert-butylamino)methyl-trifluoroboranuide
    SMILES
    [B-](CNC(C)(C)C)(F)(F)F.[K+]
    InChIKey
    OCJYVRSNCKUPKA-UHFFFAOYSA-N
    InChI
    1S/C5H12BF3N.K/c1-5(2,3)10-4-6(7,8)9;/h10H,4H2,1-3H3;/q-1;+1
    Synonyms
    MFCD10566510 | POTASSIUM [(TERT-BUTYLAMINO)METHYL]TRIFLUOROBORANUIDE | potassium(t-butylaminomethyl)trifluoroborate |...
  5. Posaconazole (SCH 56592), Cytochrome P450 51 inhibitor
    CAS: 171228-49-2 EC Number: 682-747-8 Formula: C37H42F2N8O4 Molecular Weight: 700.78
    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 #: P409129
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    Technical Identifiers
    Synonyms
    4-(4-(4-(4-(((3R,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)-tetrahydrofuran-3-yl)methoxy)phenyl)pip...
  6. Pomolic acid
    CAS: 13849-91-7 PubChem CID: 382831 Formula: C30H48O4 Molecular Weight: 472.7
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P421458
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    Technical Identifiers
    IUPAC Name
    (1R,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-1,10-dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carshow more
    SMILES
    CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1(C)O)C)C(=O)O
    InChIKey
    ZZTYPLSBNNGEIS-OPAXANQDSA-N
    InChI
    1S/C30H48O4/c1-18-10-15-30(24(32)33)17-16-27(5)19(23(30)29(18,7)34)8-9-21-26(4)13-12-22(31)25(2,3)20(26)11-14-28(21,27)6/h8,18,20-23,31,34H,9-17H2,1-7show more
    Synonyms
    SCHEMBL1049001 | Urs-12-en-28-oic acid, 3,19-dihydroxy-, (3.beta.)- | Benthamic acid | Randialic acid A | E80683 | 1,...
  7. Potassium 4-methyl-β-styryltrifluoroborate
    CAS: 219718-86-2 PubChem CID: 23666371 Formula: C9H9BF3K Molecular Weight: 224.08
    ● In Stock — US warehouse, ships to EU* Item #: P344021
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    IUPAC Name
    potassium;trifluoro-[(E)-2-(4-methylphenyl)ethenyl]boranuide
    SMILES
    [B-](C=CC1=CC=C(C=C1)C)(F)(F)F.[K+]
    InChIKey
    IHPTVBKDBKCIOO-UHDJGPCESA-N
    InChI
    1S/C9H9BF3.K/c1-8-2-4-9(5-3-8)6-7-10(11,12)13;/h2-7H,1H3;/q-1;+1/b7-6+;
  8. Potassium Iodide
    CAS: 7681-11-0 EC Number: 231-659-4 Formula: KI Molecular Weight: 166.00
    Liquid 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P408488
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    Technical Identifiers
    Synonyms
    1H-​Indole-​3-​carboxylic acid-(3-​endo)​-​8-​methyl-​8-​azabicyclo[3.2.1]​oct-​3-​yl ester, hydrochloride (1:1)
  9. Potassium guaiacolsulfonate hemihydrate
    CAS: 78247-49-1 EC Number: 682-132-4 Formula: C7H7KO5S · 0.5H2O Molecular Weight: 251.3
    2mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P425938
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    Technical Identifiers
    Synonyms
    Potassium Hydroxymethoxybenzenesulfonate | SulfogaiacolBenzenesulfonic acid,hydroxymethoxy-​,monopotassium salt,hydra...
  10. Potassium guaiacolsulfonate hemihydrate
    CAS: 78247-49-1 Formula: C7H7KO5S · 0.5H2O Molecular Weight: 251.3
    ● In Stock — US warehouse, ships to EU* Item #: P413334
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    Technical Identifiers
    Synonyms
    Potassium Hydroxymethoxybenzenesulfonate;SulfogaiacolBenzenesulfonic acid,hydroxymethoxy-​,monopotassium salt,hydrate...
  11. Potassium ionophore III
    CAS: 99348-39-7 PubChem CID: 5167704 Formula: C46H70N4O18 Molecular Weight: 967.06
    ● In Stock — US warehouse, ships to EU* Item #: P355646
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    Technical Identifiers
    IUPAC Name
    [2-methyl-2-[(18-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-yl)carbamoyloxymethyl]tetradecyl] N-(18-nitro-2,5,8,11,14-pentshow more
    SMILES
    CCCCCCCCCCCCC(C)(COC(=O)NC1=CC2=C(C=C1[N+](=O)[O-])OCCOCCOCCOCCO2)COC(=O)NC3=CC4=C(C=C3[N+](=O)[O-])OCCOCCOCCOCCO4
    InChIKey
    ATWXVVNLVXXTQN-UHFFFAOYSA-N
    InChI
    1S/C46H70N4O18/c1-3-4-5-6-7-8-9-10-11-12-13-46(2,34-67-44(51)47-36-30-40-42(32-38(36)49(53)54)65-28-24-61-20-16-57-14-18-59-22-26-63-40)35-68-45(52)48show more
    Synonyms
    2-Dodecyl-2-methylpropane-1,3-diyl bis((16-nitro-2,3,5,6,8,9,11,12-octahydrobenzo[b][1,4,7,10,13]pentaoxacyclopentade...
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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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