By Target / Pathway / Disease

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).

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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

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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. 6-chloro-N-ethylpyridazin-3-amine
    CAS: 68588-39-6 EC Number: 101-315-7 Formula: C6H8N3Cl Molecular Weight: 157.6
    Solid ≥97%
    ● In Stock — US warehouse, ships to EU* Item #: C349279
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    Technical Identifiers
    IUPAC Name
    6-chloro-N-ethylpyridazin-3-amine
    SMILES
    CCNC1=NN=C(C=C1)Cl
    InChIKey
    STAKPHFAQGICDI-UHFFFAOYSA-N
    InChI
    1S/C6H8ClN3/c1-2-8-6-4-3-5(7)9-10-6/h3-4H,2H2,1H3,(H,8,10)
    Synonyms
    F3266-0104 | STK505667 | AKOS002982540 | 6-chloro-N-ethylpyridazin-3-amine | SY065381 | 3-Chloro-6-ethylaminopyridazi...
  2. 6-chloro-7-hydroxy-4-phenyl-2H-chromen-2-one
    CAS: 53391-72-3 Formula: C15H9ClO3 Molecular Weight: 272.68
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: C424569
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    Technical Identifiers
    IUPAC Name
    6-chloro-7-hydroxy-4-phenylchromen-2-one
    SMILES
    C1=CC=C(C=C1)C2=CC(=O)OC3=CC(=C(C=C23)Cl)O
    InChIKey
    TUQNFQUMZKUALD-UHFFFAOYSA-N
    InChI
    1S/C15H9ClO3/c16-12-6-11-10(9-4-2-1-3-5-9)7-15(18)19-14(11)8-13(12)17/h1-8,17H
    Synonyms
    Q27466970 | AKOS000522234 | DTXSID50419865 | AB00090945-01 | SR-01000442904 | Oprea1_187298 | 6-chloro-7-hydroxy-4-ph...
  3. 6-keto Prostaglandin E1
    CAS: 67786-53-2 PubChem CID: 5280889 Formula: C20H32O6 Molecular Weight: 368.46
    ≥98% 1mg/mL in ethanol
    ● In Stock — US warehouse, ships to EU* Item #: K355917
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    Technical Identifiers
    IUPAC Name
    7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]-6-oxoheptanoic acid
    SMILES
    CCCCCC(C=CC1C(CC(=O)C1CC(=O)CCCCC(=O)O)O)O
    InChIKey
    ROUDCKODIMKLNO-CTBSXBMHSA-N
    InChI
    1S/C20H32O6/c1-2-3-4-7-14(21)10-11-16-17(19(24)13-18(16)23)12-15(22)8-5-6-9-20(25)26/h10-11,14,16-18,21,23H,2-9,12-13H2,1H3,(H,25,26)/b11-10+/t14-,16+show more
    Synonyms
    LMFA03010012 | Prostaglandin E1, 6-oxo | CHEBI:28269 | SR-01000946379 | 6,9-DIOXO-11ALPHA,15S-DIHYDROXY-PROST-13E-EN-...
  4. 6-chloro-N-isopropylpyridazin-3-amine
    CAS: 1007-55-2 Formula: C7H10ClN3 Molecular Weight: 171.63
    ● In Stock — US warehouse, ships to EU* Item #: C349940
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    Technical Identifiers
    IUPAC Name
    6-chloro-N-propan-2-ylpyridazin-3-amine
    SMILES
    CC(C)NC1=NN=C(C=C1)Cl
    InChIKey
    KFBDHWVJYXLFKF-UHFFFAOYSA-N
    InChI
    1S/C7H10ClN3/c1-5(2)9-7-4-3-6(8)10-11-7/h3-5H,1-2H3,(H,9,11)
    Synonyms
    AKOS000321685 | SY066184 | N-(6-CHLORO-3-PYRIDAZINYL)-N-ISOPROPYLAMINE | 6-chloro-N-propan-2-ylpyridazin-3-amine | AS...
  5. 6-chloro-7-hydroxy-4-phenyl-2H-chromen-2-one
    CAS: 53391-72-3 Formula: C15H9ClO3 Molecular Weight: 272.68
    ◐ .Made to order · 8–12 wks Item #: C349526
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    Technical Identifiers
    IUPAC Name
    6-chloro-7-hydroxy-4-phenylchromen-2-one
    SMILES
    C1=CC=C(C=C1)C2=CC(=O)OC3=CC(=C(C=C23)Cl)O
    InChIKey
    TUQNFQUMZKUALD-UHFFFAOYSA-N
    InChI
    1S/C15H9ClO3/c16-12-6-11-10(9-4-2-1-3-5-9)7-15(18)19-14(11)8-13(12)17/h1-8,17H
    Synonyms
    Q27466970 | AKOS000522234 | DTXSID50419865 | AB00090945-01 | SR-01000442904 | Oprea1_187298 | 6-chloro-7-hydroxy-4-ph...
  6. 6-chloro-3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazine
    CAS: 40971-95-7 EC Number: 885-790-2 Formula: C6H2ClF3N4 Molecular Weight: 222.56
    ◐ .Made to order · 8–12 wks Item #: C349537
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    Technical Identifiers
    IUPAC Name
    6-chloro-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine
    SMILES
    C1=CC(=NN2C1=NN=C2C(F)(F)F)Cl
    InChIKey
    IJESFQCCOFNOQG-UHFFFAOYSA-N
    InChI
    1S/C6H2ClF3N4/c7-3-1-2-4-11-12-5(6(8,9)10)14(4)13-3/h1-2H
    Synonyms
    SMR000282770 | Permanent Green Toner GT-376 | STK723017 | 6-chloro-3-(trifluoromethyl)[1,2,4]triazolo[4,3-b]pyridazin...
  7. 6-chloropyridazine-3-thiol
    CAS: 3916-78-7 Formula: C4H3ClN2S Molecular Weight: 146.59
    ● In Stock — US warehouse, ships to EU* Item #: C349932
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    IUPAC Name
    3-chloro-1H-pyridazine-6-thione
    SMILES
    C1=CC(=NNC1=S)Cl
    InChIKey
    ABQHEWLZYZQXHY-UHFFFAOYSA-N
    InChI
    1S/C4H3ClN2S/c5-3-1-2-4(8)7-6-3/h1-2H,(H,7,8)
    Synonyms
    SCHEMBL15201021 | 6-chloropyridazine-3-thiol | AKOS005173679 | BS-12809 | 3-chloro-1H-pyridazine-6-thione | SCHEMBL42...
  8. 6-ethoxynicotinic acid
    CAS: 97455-65-7 EC Number: 809-844-1 Formula: C8H9NO3 Molecular Weight: 167.17
    ● In Stock — US warehouse, ships to EU* Item #: E349238
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    Technical Identifiers
    IUPAC Name
    6-ethoxypyridine-3-carboxylic acid
    SMILES
    CCOC1=NC=C(C=C1)C(=O)O
    InChIKey
    RAMUDXNFZBUNHO-UHFFFAOYSA-N
    InChI
    1S/C8H9NO3/c1-2-12-7-4-3-6(5-9-7)8(10)11/h3-5H,2H2,1H3,(H,10,11)
    Synonyms
    3-Pyridinecarboxylic acid, 6-ethoxy- | EN300-44276 | HMS2267J12 | STK503420 | 6-ethoxypyridine-3-carboxylic acid | 6-...
  9. 680C91
    CAS: 163239-22-3 Formula: C15H11FN2 Molecular Weight: 238.26
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: C422004
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    Technical Identifiers
    IUPAC Name
    6-fluoro-3-[(E)-2-pyridin-3-ylethenyl]-1H-indole
    SMILES
    C1=CC(=CN=C1)C=CC2=CNC3=C2C=CC(=C3)F
    InChIKey
    YBSDQTBCNYWBMX-ONEGZZNKSA-N
    InChI
    1S/C15H11FN2/c16-13-5-6-14-12(10-18-15(14)8-13)4-3-11-2-1-7-17-9-11/h1-10,18H/b4-3+
    Synonyms
    MS-23388 | 680C91 | s8997 | 1H-Indole, 6-fluoro-3-[2-(3-pyridinyl)ethenyl]-, (E)-; 6-Fluoro-3-[(1E)-2-(3-pyridinyl)et...
  10. 6A,6B,6C,6D,6E,6F,6G-Heptakis-O-(2-hydroxypropyl)-β-cyclodextrin, Cholesterol sequestering agent
    CAS: 107745-73-3 Formula: C63H112O42 Molecular Weight: 1541.54
    ◐ .Made to order · 8–12 wks Item #: A347512
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    Technical Identifiers
    IUPAC Name
    (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-5,10,15,20,25show more
    SMILES
    CC(COCC1C2C(C(C(O1)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)OC5C(OC(C(C5O)O)OC6C(OC(C(C6O)O)OC7C(OC(C(C7O)O)OC8C(OC(O2)C(C8O)O)COCC(C)O)COCC(C)O)COCC(C)O)COCC(show more
    InChIKey
    ODLHGICHYURWBS-LKONHMLTSA-N
    InChI
    1S/C63H112O42/c1-22(64)8-85-15-29-50-36(71)43(78)57(92-29)100-51-30(16-86-9-23(2)65)94-59(45(80)38(51)73)102-53-32(18-88-11-25(4)67)96-61(47(82)40(53)show more
    Synonyms
    HP-beta-CD | ODLHGICHYURWBS-LKONHMLTSA-N | .beta.-Cyclodextrin, 6A,6B,6C,6D,6E,6F,6G-heptakis-O-(2-hydroxypropyl)- | ...
  11. 6H05
    CAS: 2061344-88-3 PubChem CID: 86208069 Formula: C20H30ClN3O2S3.CF3COOH Molecular Weight: 590.14
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: H422503
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    IUPAC Name
    1-[2-(4-chlorophenyl)sulfanylacetyl]-N-[2-[2-(dimethylamino)ethyldisulfanyl]ethyl]piperidine-4-carboxamide;2,2,2-trifluoroacetic acid
    SMILES
    CN(C)CCSSCCNC(=O)C1CCN(CC1)C(=O)CSC2=CC=C(C=C2)Cl.C(=O)(C(F)(F)F)O
    InChIKey
    YNMYIJSFFJXIRV-UHFFFAOYSA-N
    InChI
    1S/C20H30ClN3O2S3.C2HF3O2/c1-23(2)12-14-29-28-13-9-22-20(26)16-7-10-24(11-8-16)19(25)15-27-18-5-3-17(21)4-6-18;3-2(4,5)1(6)7/h3-6,16H,7-15H2,1-2H3,(H,show more
    Synonyms
    1-[2-[(4-chlorophenyl)thio]acetyl]-N-[2-[[2-(dimethylamino)ethyl]dithio]ethyl]-4-piperidinecarboxamide,2,2,2-trifluor...
  12. 6H05 (TFA)
    CAS: 2061344-88-3 PubChem CID: 86208069 Formula: C20H30ClN3O2S3.CF3COOH Molecular Weight: 590.14
    ● In Stock — US warehouse, ships to EU* Item #: H413737
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    Technical Identifiers
    IUPAC Name
    1-[2-(4-chlorophenyl)sulfanylacetyl]-N-[2-[2-(dimethylamino)ethyldisulfanyl]ethyl]piperidine-4-carboxamide;2,2,2-trifluoroacetic acid
    SMILES
    CN(C)CCSSCCNC(=O)C1CCN(CC1)C(=O)CSC2=CC=C(C=C2)Cl.C(=O)(C(F)(F)F)O
    InChIKey
    YNMYIJSFFJXIRV-UHFFFAOYSA-N
    InChI
    1S/C20H30ClN3O2S3.C2HF3O2/c1-23(2)12-14-29-28-13-9-22-20(26)16-7-10-24(11-8-16)19(25)15-27-18-5-3-17(21)4-6-18;3-2(4,5)1(6)7/h3-6,16H,7-15H2,1-2H3,(H,show more
    Synonyms
    1-[2-(4-chlorophenyl)sulfanylacetyl]-N-[2-[2-(dimethylamino)ethyldisulfanyl]ethyl]piperidine-4-carboxamide | 2,2,2-tr...
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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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