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. WAY-325671-A
    CAS: 869355-88-4 PubChem CID: 16251637 Formula: C22H19FN4O6 Molecular Weight: 454.4
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: W426504
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    Technical Identifiers
    IUPAC Name
    [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 1-(4-fluorobenzoyl)piperidine-4-carboxylate
    SMILES
    C1CN(CCC1C(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)F
    InChIKey
    SONGMQHIHXTVGY-UHFFFAOYSA-N
    InChI
    1S/C22H19FN4O6/c23-17-5-1-15(2-6-17)21(28)26-11-9-16(10-12-26)22(29)32-13-19-24-25-20(33-19)14-3-7-18(8-4-14)27(30)31/h1-8,16H,9-13H2
  2. WAY-325680
    CAS: 869356-38-7 PubChem CID: 16251248 Formula: C21H25NO3 Molecular Weight: 339.4
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: W426506
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    Technical Identifiers
    IUPAC Name
    N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-3-methylbenzamide
    SMILES
    CC1=CC(=CC=C1)C(=O)NC(C2=CC3=C(C=C2)OCCCO3)C(C)C
    InChIKey
    KIEOMCAKWWMYKD-UHFFFAOYSA-N
    InChI
    1S/C21H25NO3/c1-14(2)20(22-21(23)17-7-4-6-15(3)12-17)16-8-9-18-19(13-16)25-11-5-10-24-18/h4,6-9,12-14,20H,5,10-11H2,1-3H3,(H,22,23)
  3. WAY-325691
    CAS: 869356-91-2 PubChem CID: 8195695 Formula: C15H10ClNO3 Molecular Weight: 287.7
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W426507
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    Technical Identifiers
    IUPAC Name
    3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(3-methoxyphenyl)-4-methyl-1,2,4-triazole
    SMILES
    CN1C(=NN=C1SCC2=CC(=CC3=C2OCOC3)Cl)C4=CC(=CC=C4)OC
    InChIKey
    DBYNNFWUCONORP-UHFFFAOYSA-N
    InChI
    1S/C19H18ClN3O3S/c1-23-18(12-4-3-5-16(8-12)24-2)21-22-19(23)27-10-14-7-15(20)6-13-9-25-11-26-17(13)14/h3-8H,9-11H2,1-2H3
  4. WAY-325695
    CAS: 869357-04-0 PubChem CID: 7950375 Formula: C18H17ClN2O4S Molecular Weight: 392.9
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: W426508
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    Technical Identifiers
    IUPAC Name
    2-[(2-chlorophenyl)sulfanylmethyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
    SMILES
    COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)CSC3=CC=CC=C3Cl
    InChIKey
    SXAVIFMBBNGEQR-UHFFFAOYSA-N
    InChI
    1S/C18H17ClN2O4S/c1-22-13-8-11(9-14(23-2)17(13)24-3)18-21-20-16(25-18)10-26-15-7-5-4-6-12(15)19/h4-9H,10H2,1-3H3
  5. WAY-326081
    CAS: 869713-00-8 PubChem CID: 72091467 Formula: C24H26N4O5 Molecular Weight: 422.5
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W426522
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    Technical Identifiers
    IUPAC Name
    [2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl] 1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxylate
    SMILES
    CC1(C2=CC=CC=C2N(C1=CC(=O)COC(=O)C3CC(=O)N(C3)CC4=CC=CO4)C)C
    InChIKey
    QWGQVAILEKVRQH-UHFFFAOYSA-N
    InChI
    1S/C24H26N2O5/c1-24(2)19-8-4-5-9-20(19)25(3)21(24)12-17(27)15-31-23(29)16-11-22(28)26(13-16)14-18-7-6-10-30-18/h4-10,12,16H,11,13-15H2,1-3H3
  6. WAY-326100
    CAS: 869714-20-5 PubChem CID: 7997410 Formula: C18H20Cl2N2O2S Molecular Weight: 399.33
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: W426525
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    Technical Identifiers
    IUPAC Name
    1-(2,5-dichlorophenyl)sulfonyl-4-(2-phenylethyl)piperazine
    SMILES
    C1CN(CCN1CCC2=CC=CC=C2)S(=O)(=O)C3=C(C=CC(=C3)Cl)Cl
    InChIKey
    WMMZYEPDPXDBBV-UHFFFAOYSA-N
    InChI
    1S/C18H20Cl2N2O2S/c19-16-6-7-17(20)18(14-16)25(23,24)22-12-10-21(11-13-22)9-8-15-4-2-1-3-5-15/h1-7,14H,8-13H2
  7. WAY-325522
    CAS: 868270-08-0 PubChem CID: 5244293 Formula: C21H20N2O5S2 Molecular Weight: 444.5
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W426475
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    Technical Identifiers
    IUPAC Name
    [2-[(1,1-dioxothiolan-3-yl)-methylamino]-2-oxoethyl] 2-thiophen-2-ylquinoline-4-carboxylate
    SMILES
    CN(C1CCS(=O)(=O)C1)C(=O)COC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4
    InChIKey
    IRFXUXQZFFIADH-UHFFFAOYSA-N
    InChI
    1S/C21H20N2O5S2/c1-23(14-8-10-30(26,27)13-14)20(24)12-28-21(25)16-11-18(19-7-4-9-29-19)22-17-6-3-2-5-15(16)17/h2-7,9,11,14H,8,10,12-13H2,1H3
  8. WAY-325604
    CAS: 869351-81-5 PubChem CID: 16251943 Formula: C15H13FN4O Molecular Weight: 284.29
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W426495
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    Technical Identifiers
    IUPAC Name
    2-(4-fluorophenoxy)ethyl 2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetate
    SMILES
    CC1CCCCC12C(=O)N(C(=O)N2)CC(=O)OCCOC3=CC=C(C=C3)F
    InChIKey
    OHNZMYAQLITJSB-UHFFFAOYSA-N
    InChI
    1S/C19H23FN2O5/c1-13-4-2-3-9-19(13)17(24)22(18(25)21-19)12-16(23)27-11-10-26-15-7-5-14(20)6-8-15/h5-8,13H,2-4,9-12H2,1H3,(H,21,25)
  9. WAY-325606
    CAS: 869351-84-8 PubChem CID: 16251940 Formula: C21H19FN2O3S Molecular Weight: 398.45
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: W426496
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    Technical Identifiers
    IUPAC Name
    N-[2-[(5Z)-5-[(4-fluorophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-2-(4-methylphenyl)acetamide
    SMILES
    CC1=CC=C(C=C1)CC(=O)NCCN2C(=O)C(=CC3=CC=C(C=C3)F)SC2=O
    InChIKey
    LERNYLCUXOQKFR-PDGQHHTCSA-N
    InChI
    1S/C21H19FN2O3S/c1-14-2-4-16(5-3-14)13-19(25)23-10-11-24-20(26)18(28-21(24)27)12-15-6-8-17(22)9-7-15/h2-9,12H,10-11,13H2,1H3,(H,23,25)/b18-12-
  10. WAY-325616
    CAS: 869352-15-8 PubChem CID: 16251939 Formula: C25H21ClN4OS Molecular Weight: 460.98
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W426497
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    Technical Identifiers
    IUPAC Name
    6-[[5-(4-chlorophenyl)-4-(2-methoxyethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenanthridine
    SMILES
    COCCN1C(=NN=C1SCC2=NC3=CC=CC=C3C4=CC=CC=C42)C5=CC=C(C=C5)Cl
    InChIKey
    HLVSFVPRRWEOLK-UHFFFAOYSA-N
    InChI
    1S/C25H21ClN4OS/c1-31-15-14-30-24(17-10-12-18(26)13-11-17)28-29-25(30)32-16-23-21-8-3-2-6-19(21)20-7-4-5-9-22(20)27-23/h2-13H,14-16H2,1H3
  11. WAY-326102
    CAS: 869714-30-7 PubChem CID: 16252834 Formula: C20H22N4O4S2 Molecular Weight: 446.54
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: W426527
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    Technical Identifiers
    IUPAC Name
    N-[3-(dimethylsulfamoyl)phenyl]-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yloxy)acetamide
    SMILES
    CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=O)COC2=C3C4=C(CCCC4)SC3=NC=N2
    InChIKey
    DWPVJVGNOGQILC-UHFFFAOYSA-N
    InChI
    1S/C20H22N4O4S2/c1-24(2)30(26,27)14-7-5-6-13(10-14)23-17(25)11-28-19-18-15-8-3-4-9-16(15)29-20(18)22-12-21-19/h5-7,10,12H,3-4,8-9,11H2,1-2H3,(H,23,25)
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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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