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. CL-236770
    CAS: 853694-04-9 PubChem CID: 4789149 Formula: C20H17FN2O3 Molecular Weight: 352.4
    ● In Stock — US warehouse, ships to EU* Item #: C416688
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    Technical Identifiers
    IUPAC Name
    N-[5-[(4-fluoro-2-methylphenyl)carbamoyl]-2-methylphenyl]furan-2-carboxamide
    SMILES
    CC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)F)C)NC(=O)C3=CC=CO3
    InChIKey
    QFGOIVAGAURAEJ-UHFFFAOYSA-N
    InChI
    1S/C20H17FN2O3/c1-12-5-6-14(11-17(12)23-20(25)18-4-3-9-26-18)19(24)22-16-8-7-15(21)10-13(16)2/h3-11H,1-2H3,(H,22,24)(H,23,25)
    Synonyms
    N-[5-[[(4-fluoro-2-methylphenyl)amino]carbonyl]-2-methylphenyl]-2-Furancarboxamide
  2. CL-2660
    CAS: 853694-34-5 PubChem CID: 4789155 Formula: C20H24N2O4S Molecular Weight: 388.5
    ● In Stock — US warehouse, ships to EU* Item #: C416690
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    IUPAC Name
    N-(4-methoxyphenyl)-4-(4-methylpiperidine-1-carbonyl)benzenesulfonamide
    SMILES
    CC1CCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)OC
    InChIKey
    CCCOUORAUKBTBH-UHFFFAOYSA-N
    InChI
    1S/C20H24N2O4S/c1-15-11-13-22(14-12-15)20(23)16-3-9-19(10-4-16)27(24,25)21-17-5-7-18(26-2)8-6-17/h3-10,15,21H,11-14H2,1-2H3
    Synonyms
    N-(4-methoxyphenyl)-4-(4-methylpiperidine-1-carbonyl)benzenesulfonamide
  3. CL-285821
    CAS: 909859-95-6 PubChem CID: 3240843 Formula: C25H23N5O5 Molecular Weight: 473.5
    ● In Stock — US warehouse, ships to EU* Item #: C416693
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    IUPAC Name
    [4-[6-amino-5-cyano-3-(4-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenyl] morpholine-4-carboxylate
    SMILES
    COC1=CC=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=C(C=C4)OC(=O)N5CCOCC5
    InChIKey
    YHTAWAIXNNYKCV-UHFFFAOYSA-N
    InChI
    1S/C25H23N5O5/c1-32-17-6-4-16(5-7-17)22-21-20(19(14-26)23(27)35-24(21)29-28-22)15-2-8-18(9-3-15)34-25(31)30-10-12-33-13-11-30/h2-9,20H,10-13,27H2,1H3,show more
    Synonyms
    4-(6-amino-5-cyano-3-(4-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl morpholine-4-carboxylate
  4. CL-349010
    CAS: 868269-33-4 PubChem CID: 8195298 Formula: C21H18FNO5 Molecular Weight: 383.37
    ● In Stock — US warehouse, ships to EU* Item #: C416699
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    IUPAC Name
    (7,8-dimethyl-2-oxochromen-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate
    SMILES
    CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)CNC(=O)C3=CC=CC=C3F)C
    InChIKey
    YHTQFIFMUZOZLE-UHFFFAOYSA-N
    InChI
    1S/C21H18FNO5/c1-12-7-8-15-14(9-18(24)28-20(15)13(12)2)11-27-19(25)10-23-21(26)16-5-3-4-6-17(16)22/h3-9H,10-11H2,1-2H3,(H,23,26)
    Synonyms
    (7,8-Dimethyl-2-oxo-2H-chromen-4-yl)methyl (2-fluorobenzoyl)glycinate
  5. CL-409141
    CAS: 332390-37-1 Formula: C21H18N4O2S Molecular Weight: 390.46
    ● In Stock — US warehouse, ships to EU* Item #: C416703
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    Technical Identifiers
    SMILES
    COC1=C(C=CC=C1)/C=N/NC(=O)C2=CC3=C(S2)[N](N=C3C)C4=CC=CC=C4
  6. CL-416300
    CAS: 868269-48-1 PubChem CID: 2559728 Formula: C15H13Cl2NO4 Molecular Weight: 342.2
    ● In Stock — US warehouse, ships to EU* Item #: C416707
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    Technical Identifiers
    IUPAC Name
    [2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl] 5-methylfuran-2-carboxylate
    SMILES
    CC1=CC=C(O1)C(=O)OCC(=O)NCC2=C(C=C(C=C2)Cl)Cl
    InChIKey
    HXOAZXZUXBCVOH-UHFFFAOYSA-N
    InChI
    1S/C15H13Cl2NO4/c1-9-2-5-13(22-9)15(20)21-8-14(19)18-7-10-3-4-11(16)6-12(10)17/h2-6H,7-8H2,1H3,(H,18,19)
  7. CL-424032
    CAS: 312634-62-1 Formula: C12H7F3N4O2 Molecular Weight: 296.2
    ● In Stock — US warehouse, ships to EU* Item #: C416712
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    IUPAC Name
    5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
    SMILES
    C1=COC(=C1)C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C(=O)N
    InChIKey
    UUBSWHIZOFRMTQ-UHFFFAOYSA-N
    InChI
    1S/C12H7F3N4O2/c13-12(14,15)9-4-6(8-2-1-3-21-8)17-10-5-7(11(16)20)18-19(9)10/h1-5H,(H2,16,20)
    Synonyms
    5-(2-furanyl)-7-(trifluoromethyl)-Pyrazolo[1,5-a]pyrimidine-2-carboxamide
  8. 2-[(3-chloro-4-fluorophenyl)amino]-N-[4-(piperidine-1-sulfonyl)phenyl]acetamide
    CAS: 853695-44-0 PubChem CID: 4789172 Formula: C19H21ClFN3O3S Molecular Weight: 425.9
    ● In Stock — US warehouse, ships to EU* Item #: C416717
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    IUPAC Name
    2-(3-chloro-4-fluoroanilino)-N-(4-piperidin-1-ylsulfonylphenyl)acetamide
    SMILES
    C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CNC3=CC(=C(C=C3)F)Cl
    InChIKey
    VXFKIHSAOLPRJD-UHFFFAOYSA-N
    InChI
    1S/C19H21ClFN3O3S/c20-17-12-15(6-9-18(17)21)22-13-19(25)23-14-4-7-16(8-5-14)28(26,27)24-10-2-1-3-11-24/h4-9,12,22H,1-3,10-11,13H2,(H,23,25)
  9. CL-230482
    CAS: 909859-35-4 PubChem CID: 2997731 Formula: C11H14N2O4 Molecular Weight: 238.24
    ◐ .Made to order · 8–12 wks Item #: C417999
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    IUPAC Name
    ethyl 5-acetyl-2-amino-1-methyl-6-oxopyridine-3-carboxylate
    SMILES
    CCOC(=O)C1=C(N(C(=O)C(=C1)C(=O)C)C)N
    InChIKey
    ZMINDHZDQBHQJT-UHFFFAOYSA-N
    InChI
    1S/C11H14N2O4/c1-4-17-11(16)8-5-7(6(2)14)10(15)13(3)9(8)12/h5H,4,12H2,1-3H3
  10. Camylofine
    CAS: 54-30-8 EC Number: 200-202-0 Formula: C19H32N2O2 Molecular Weight: 320.47
    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 #: C418532
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    IUPAC Name
    3-methylbutyl 2-[2-(diethylamino)ethylamino]-2-phenylacetate
    SMILES
    CCN(CC)CCNC(C1=CC=CC=C1)C(=O)OCCC(C)C
    InChIKey
    RYOOHIUJEJZCFT-UHFFFAOYSA-N
    InChI
    1S/C19H32N2O2/c1-5-21(6-2)14-13-20-18(17-10-8-7-9-11-17)19(22)23-15-12-16(3)4/h7-11,16,18,20H,5-6,12-15H2,1-4H3
    Synonyms
    Avocan | Tox21_112157_1 | 3-methyl butyl 2-(2-diethyl amino ethyl amino)-2-phenyl acetate | CHEBI:95216 | Belosin | C...
  11. Carvedilol EP Impurity A
    CAS: 1198090-73-1 Formula: C36H43N3O7 Molecular Weight: 629.74
    ● In Stock — US warehouse, ships to EU* Item #: C418541
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    IUPAC Name
    1-[4-[2-hydroxy-3-[2-(2-methoxyphenoxy)ethylamino]propoxy]carbazol-9-yl]-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol
    SMILES
    COC1=CC=CC=C1OCCNCC(CN2C3=C(C4=CC=CC=C42)C(=CC=C3)OCC(CNCCOC5=CC=CC=C5OC)O)O
    InChIKey
    BUCQRVKKTLMWQH-UHFFFAOYSA-N
    InChI
    1S/C36H43N3O7/c1-42-31-13-5-7-15-33(31)44-20-18-37-22-26(40)24-39-29-11-4-3-10-28(29)36-30(39)12-9-17-35(36)46-25-27(41)23-38-19-21-45-34-16-8-6-14-32show more
    Synonyms
    N-2-Hydroxy-3-[[2-(methoxyphenoxy)ethyl]amine Carvedilol | A1-02993 | 1-[[9-[2-Hydroxy-3-[[2-(2-methoxy-phenoxy)ethyl...
  12. Corynoxine
    CAS: 6877-32-3 EC Number: 683-140-0 Formula: C22H28N2O4 Molecular Weight: 384.47
    ● In Stock — US warehouse, ships to EU* Item #: C418560
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    Technical Identifiers
    IUPAC Name
    methyl (E)-2-[(3S,6'S,7'S,8'aS)-6'-ethyl-2-oxospiro[1H-indole-3,1'-3,5,6,7,8,8a-hexahydro-2H-indolizine]-7'-yl]-3-methoxyprop-2-enoate
    SMILES
    CCC1CN2CCC3(C2CC1C(=COC)C(=O)OC)C4=CC=CC=C4NC3=O
    InChIKey
    DAXYUDFNWXHGBE-NRAMRBJXSA-N
    InChI
    1S/C22H28N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26)/b16-13+/show more
    Synonyms
    CHEBI:70072 | CCG-268458 | Corynoxine | 1443767-78-9 | AC-34387 | AKOS032948990 | AS-78371 | (E)-methyl 2-((1'S,6'S,7...
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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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