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.

Products

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  1. WAY-324914
    CAS: 625370-60-7 PubChem CID: 1004136 Formula: C23H20FN3O4S Molecular Weight: 453.49
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W425169
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    Technical Identifiers
    IUPAC Name
    3-amino-6-(4-fluorophenyl)-N-(3,4,5-trimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
    SMILES
    COC1=CC(=CC(=C1OC)OC)NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC=C(C=C4)F)N
    InChIKey
    YCDOZOZCBVVKBS-UHFFFAOYSA-N
    InChI
    1S/C23H20FN3O4S/c1-29-17-10-14(11-18(30-2)20(17)31-3)26-22(28)21-19(25)15-8-9-16(27-23(15)32-21)12-4-6-13(24)7-5-12/h4-11H,25H2,1-3H3,(H,26,28)
  2. WAY-324979
    CAS: 221120-57-6 PubChem CID: 712811 Formula: C14H13ClN4S Molecular Weight: 304.79782
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W422649
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    Technical Identifiers
    IUPAC Name
    3-[(2-chlorophenyl)methylsulfanyl]-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine
    SMILES
    CC1=CC(=NC2=NN=C(N12)SCC3=CC=CC=C3Cl)C
    InChIKey
    DTXISKFUVTXHTD-UHFFFAOYSA-N
    InChI
    1S/C14H13ClN4S/c1-9-7-10(2)19-13(16-9)17-18-14(19)20-8-11-5-3-4-6-12(11)15/h3-7H,8H2,1-2H3
  3. WAY-325003
    CAS: 670256-05-0 Formula: C23H30N2O4S Molecular Weight: 430.56
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W425377
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    Technical Identifiers
    SMILES
    CC1=CC(=CC(=C1C)[S](=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCOCC3)C(C)(C)C
  4. WAY-325006
    CAS: 633279-99-9 PubChem CID: 1265490 Formula: C23H16N2O4S Molecular Weight: 416.45
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W425210
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    Technical Identifiers
    IUPAC Name
    N-(14-methyl-8,15-dioxo-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17)-heptaen-10-yl)benzenesulfonamide
    SMILES
    CN1C2=C3C(=CC1=O)C4=CC=CC=C4C(=O)C3=C(C=C2)NS(=O)(=O)C5=CC=CC=C5
    InChIKey
    WJSRFFNGNHNJLM-UHFFFAOYSA-N
    InChI
    1S/C23H16N2O4S/c1-25-19-12-11-18(24-30(28,29)14-7-3-2-4-8-14)22-21(19)17(13-20(25)26)15-9-5-6-10-16(15)23(22)27/h2-13,24H,1H3
  5. WAY-325010
    CAS: 670259-16-2 Formula: C23H15FN2O4S Molecular Weight: 434.44
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W425378
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    Technical Identifiers
    IUPAC Name
    4-fluoro-N-(14-methyl-8,15-dioxo-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17)-heptaen-10-yl)benzenesulfonamide
    SMILES
    CN1C2=C3C(=CC1=O)C4=CC=CC=C4C(=O)C3=C(C=C2)NS(=O)(=O)C5=CC=C(C=C5)F
    InChIKey
    BTEJGTMVORRRKC-UHFFFAOYSA-N
    InChI
    1S/C23H15FN2O4S/c1-26-19-11-10-18(25-31(29,30)14-8-6-13(24)7-9-14)22-21(19)17(12-20(26)27)15-4-2-3-5-16(15)23(22)28/h2-12,25H,1H3
  6. WAY-325065
    CAS: 689762-76-3 PubChem CID: 899174 Formula: C16H17N7S Molecular Weight: 339.41808
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W425534
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    Technical Identifiers
    IUPAC Name
    2-N-(3-methylphenyl)-6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine
    SMILES
    CC1=CC(=CC=C1)NC2=NC(=NC(=N2)N)CSC3=NC=CC(=N3)C
    InChIKey
    AYJVDGUGUZMEES-UHFFFAOYSA-N
    InChI
    1S/C16H17N7S/c1-10-4-3-5-12(8-10)20-15-22-13(21-14(17)23-15)9-24-16-18-7-6-11(2)19-16/h3-8H,9H2,1-2H3,(H3,17,20,21,22,23)
  7. WAY-325081
    CAS: 488714-91-6 PubChem CID: 2926900 Formula: C23H24N2O4 Molecular Weight: 392.45
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W424232
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    Technical Identifiers
    IUPAC Name
    (2,2,4-trimethyl-3,4-dihydro-1H-quinolin-6-yl) 2-(1,3-dioxoisoindol-2-yl)propanoate
    SMILES
    CC1CC(NC2=C1C=C(C=C2)OC(=O)C(C)N3C(=O)C4=CC=CC=C4C3=O)(C)C
    InChIKey
    YQDJHIQTWKFJCH-UHFFFAOYSA-N
    InChI
    1S/C23H24N2O4/c1-13-12-23(3,4)24-19-10-9-15(11-18(13)19)29-22(28)14(2)25-20(26)16-7-5-6-8-17(16)21(25)27/h5-11,13-14,24H,12H2,1-4H3
  8. WAY-325089
    CAS: 483977-96-4 PubChem CID: 844996 Formula: C16H14N4OS2 Molecular Weight: 342.44
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W424201
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    Technical Identifiers
    IUPAC Name
    2-(4-methylpyrimidin-2-yl)sulfanyl-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
    SMILES
    CC1=NC(=NC=C1)SCC(=O)NC2=NC(=CS2)C3=CC=CC=C3
    InChIKey
    NPUHSXHGNHDDIS-UHFFFAOYSA-N
    InChI
    1S/C16H14N4OS2/c1-11-7-8-17-15(18-11)23-10-14(21)20-16-19-13(9-22-16)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,20,21)
  9. WAY-324093
    CAS: 372171-81-8 PubChem CID: 1900101 Formula: C19H25N5S Molecular Weight: 355.5
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W423671
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    Pricing & Pack Sizes
    Technical Identifiers
    IUPAC Name
    N-(8-ethyl-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12,14,16-hexaen-13-yl)-N',N'-dimethylethane-1,2-diamine
    SMILES
    CCC1=NC2=C(C3=C1CCCC3)C4=C(S2)C(=NC=N4)NCCN(C)C
    InChIKey
    IHHAGZWQEFITLI-UHFFFAOYSA-N
    InChI
    1S/C19H25N5S/c1-4-14-12-7-5-6-8-13(12)15-16-17(25-19(15)23-14)18(22-11-21-16)20-9-10-24(2)3/h11H,4-10H2,1-3H3,(H,20,21,22)
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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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