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).

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. Fumaric acid
    CAS: 110-17-8 EC Number: 203-743-0 Formula: C4H4O4 Molecular Weight: 116.07
    Liquid 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: F420591
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    Technical Identifiers
    IUPAC Name
    (E)-but-2-enedioic acid
    SMILES
    C(=CC(=O)O)C(=O)O
    InChIKey
    VZCYOOQTPOCHFL-OWOJBTEDSA-N
    InChI
    1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1+
    Synonyms
    fumaric acid|110-17-8|trans-Butenedioic acid|Allomaleic acid|fumarate|Lichenic acid|Boletic acid|2-Butenedioic acid|(...
  2. Ftaxilide
    CAS: 19368-18-4 Formula: C16H15NO3 Molecular Weight: 269.3
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: F422365
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    Technical Identifiers
    IUPAC Name
    2-[(2,6-dimethylphenyl)carbamoyl]benzoic acid
    SMILES
    CC1=C(C(=CC=C1)C)NC(=O)C2=CC=CC=C2C(=O)O
    InChIKey
    LLECMGGNFBKPRH-UHFFFAOYSA-N
    InChI
    1S/C16H15NO3/c1-10-6-5-7-11(2)14(10)17-15(18)12-8-3-4-9-13(12)16(19)20/h3-9H,1-2H3,(H,17,18)(H,19,20)
    Synonyms
    4,4'-Thiobis(2-tert-butyl-6-methylphenol) | FTAXILIDE [INN] | Tox21_111986 | AKOS001678089 | Salicylic acid, 5-nitro-...
  3. Diloxanide furoate
    CAS: 3736-81-0 EC Number: 223-108-1 Formula: C14H11Cl2NO4 Molecular Weight: 328.15
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥95%
    ◐ .Made to order · 8–12 wks Item #: F336827
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    IUPAC Name
    [4-[(2,2-dichloroacetyl)-methylamino]phenyl] furan-2-carboxylate
    SMILES
    CN(C1=CC=C(C=C1)OC(=O)C2=CC=CO2)C(=O)C(Cl)Cl
    InChIKey
    BDYYDXJSHYEDGB-UHFFFAOYSA-N
    InChI
    1S/C14H11Cl2NO4/c1-17(13(18)12(15)16)9-4-6-10(7-5-9)21-14(19)11-3-2-8-20-11/h2-8,12H,1H3
    Synonyms
    Diloxanide furoate (TN) | NSC759146 | NSC-759146 | 2-Furoic acid, ester with 2,2-dichloro-4'-hydroxy-N-methylacetanil...
  4. Furan-2-ylmethyl-(2-methoxy-benzyl)-amine
    CAS: 225236-02-2 Formula: C13H15NO2 Molecular Weight: 217.27
    ● In Stock — US warehouse, ships to EU* Item #: F338573
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    Technical Identifiers
    IUPAC Name
    N-(furan-2-ylmethyl)-1-(2-methoxyphenyl)methanamine
    SMILES
    COC1=CC=CC=C1CNCC2=CC=CO2
    InChIKey
    WKNQLAHUYDYUNM-UHFFFAOYSA-N
    InChI
    1S/C13H15NO2/c1-15-13-7-3-2-5-11(13)9-14-10-12-6-4-8-16-12/h2-8,14H,9-10H2,1H3
    Synonyms
    N-(furan-2-ylmethyl)-1-(2-methoxyphenyl)methanamine | AB00089637-01 | Oprea1_232060 | STK127755 | NCGC00319331-01 | A...
  5. Furan-2-ylmethyl-(3-methyl-1-p-tolyl-but-3-enyl)-amine
    CAS: 436087-19-3 PubChem CID: 3150633 Formula: C17H21NO Molecular Weight: 255.36
    ◐ .Made to order · 8–12 wks Item #: F338061
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    IUPAC Name
    N-(furan-2-ylmethyl)-3-methyl-1-(4-methylphenyl)but-3-en-1-amine
    SMILES
    CC1=CC=C(C=C1)C(CC(=C)C)NCC2=CC=CO2
    InChIKey
    KFBRGCKMQKZGPT-UHFFFAOYSA-N
    InChI
    1S/C17H21NO/c1-13(2)11-17(15-8-6-14(3)7-9-15)18-12-16-5-4-10-19-16/h4-10,17-18H,1,11-12H2,2-3H3
    Synonyms
    DTXSID80389921 | N-(Furan-2-ylmethyl)-3-methyl-1-(p-tolyl)but-3-en-1-amine | N-(furan-2-ylmethyl)-3-methyl-1-p-tolylb...
  6. Furan-2-ylmethyl-[1-(4-methoxy-phenyl)-but-3-enyl]-amine
    CAS: 340025-61-8 Formula: C16H19NO2 Molecular Weight: 257.34
    ● In Stock — US warehouse, ships to EU* Item #: F338300
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    Technical Identifiers
    IUPAC Name
    N-(furan-2-ylmethyl)-1-(4-methoxyphenyl)but-3-en-1-amine
    SMILES
    COC1=CC=C(C=C1)C(CC=C)NCC2=CC=CO2
    InChIKey
    KLECXMIWSBQFFU-UHFFFAOYSA-N
    InChI
    1S/C16H19NO2/c1-3-5-16(17-12-15-6-4-11-19-15)13-7-9-14(18-2)10-8-13/h3-4,6-11,16-17H,1,5,12H2,2H3
    Synonyms
    Oprea1_026242 | Furan-2-ylmethyl-[1-(4-methoxy-phenyl)-but-3-enyl]-amine | furan-2-ylmethyl-[1-(4-methoxyphenyl)but-3...
  7. Furagin
    CAS: 1672-88-4 Formula: C10H8N4O5 Molecular Weight: 264.19
    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 #: F422073
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    IUPAC Name
    1-[(E)-[(E)-3-(5-nitrofuran-2-yl)prop-2-enylidene]amino]imidazolidine-2,4-dione
    SMILES
    C1C(=O)NC(=O)N1N=CC=CC2=CC=C(O2)[N+](=O)[O-]
    InChIKey
    DECBQELQORZLLP-UAIOPKHMSA-N
    InChI
    1S/C10H8N4O5/c15-8-6-13(10(16)12-8)11-5-1-2-7-3-4-9(19-7)14(17)18/h1-5H,6H2,(H,12,15,16)/b2-1+,11-5+
    Synonyms
    1-(3-(5-nitro-2-furyl)-n-2-propenylidine)aminohydantoin | 1-(3-(5-Nitro-2-furyl)-N-2-propenylidine)amino-hydantoin | ...
  8. Furan-2-sulphonyl chloride
    CAS: 52665-48-2 EC Number: 800-355-9 Formula: C4H3ClO3S Molecular Weight: 166.58
    ● In Stock — US warehouse, ships to EU* Item #: F339412
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    Technical Identifiers
    IUPAC Name
    furan-2-sulfonyl chloride
    SMILES
    C1=COC(=C1)S(=O)(=O)Cl
    InChIKey
    IEKOSPNJXYCZHY-UHFFFAOYSA-N
    InChI
    1S/C4H3ClO3S/c5-9(6,7)4-2-1-3-8-4/h1-3H
    Synonyms
    AKOS010077826 | EN300-139041 | 2-Furansulfonyl chloride | SCHEMBL18456 | J-521394 | furan-2-ylsulfonyl chloride | BBL...
  9. Furan-2-ylmethyl-[2-(1H-indol-3-yl)-ethyl]-amine
    CAS: 77960-15-7 Formula: C15H16N2O Molecular Weight: 240.31
    ● In Stock — US warehouse, ships to EU* Item #: F339403
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    Technical Identifiers
    IUPAC Name
    N-(furan-2-ylmethyl)-2-(1H-indol-3-yl)ethanamine
    SMILES
    C1=CC=C2C(=C1)C(=CN2)CCNCC3=CC=CO3
    InChIKey
    FELGUJHGLNZYPV-UHFFFAOYSA-N
    InChI
    1S/C15H16N2O/c1-2-6-15-14(5-1)12(10-17-15)7-8-16-11-13-4-3-9-18-13/h1-6,9-10,16-17H,7-8,11H2
    Synonyms
    N-(Furan-2-ylmethyl)-2-(1H-indol-3-yl)ethanamine
  10. Ftaxilide
    CAS: 19368-18-4 Formula: C16H15NO3 Molecular Weight: 269.3
    ● In Stock — US warehouse, ships to EU* Item #: F413466
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    Technical Identifiers
    IUPAC Name
    2-[(2,6-dimethylphenyl)carbamoyl]benzoic acid
    SMILES
    CC1=C(C(=CC=C1)C)NC(=O)C2=CC=CC=C2C(=O)O
    InChIKey
    LLECMGGNFBKPRH-UHFFFAOYSA-N
    InChI
    1S/C16H15NO3/c1-10-6-5-7-11(2)14(10)17-15(18)12-8-3-4-9-13(12)16(19)20/h3-9H,1-2H3,(H,17,18)(H,19,20)
    Synonyms
    4,4'-Thiobis(2-tert-butyl-6-methylphenol) | FTAXILIDE [INN] | Tox21_111986 | AKOS001678089 | Salicylic acid, 5-nitro-...
  11. Furan-2-carboxylic acid (4-amino-phenyl)-amide
    CAS: 21838-58-4 Formula: C11H10N2O2 Molecular Weight: 202.21
    ● In Stock — US warehouse, ships to EU* Item #: F339413
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    Technical Identifiers
    IUPAC Name
    N-(4-aminophenyl)furan-2-carboxamide
    SMILES
    C1=COC(=C1)C(=O)NC2=CC=C(C=C2)N
    InChIKey
    HWMFFWCDLWDYGX-UHFFFAOYSA-N
    InChI
    1S/C11H10N2O2/c12-8-3-5-9(6-4-8)13-11(14)10-2-1-7-15-10/h1-7H,12H2,(H,13,14)
    Synonyms
    Furan-2-carboxylic acid (4-amino-phenyl)-amide | Z57243692 | STK299522 | MFCD01171822 | N-(4-aminophenyl)-2-furamide...
  12. Fulvestrant (ICI-182780), Estrogen receptor antagonist
    CAS: 129453-61-8 EC Number: 642-998-6 Formula: C32H47F5O3S Molecular Weight: 606.77
    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 #: F408459
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    Technical Identifiers
    Synonyms
    ZD 9238, ZM 182780 | 7-​[9-​[(4,​4,​5,​5,​5-​pentafluoropentyl)​sulfinyl]​nonyl]​-​ (7α,​17β)​-estra-​1,​3,​5(10)​-​t...
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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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