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. Ethyl 6-bromo-8-chloro-4-hydroxy-quinoline-3-carboxylate
    CAS: 217316-19-3 PubChem CID: 2797073 Formula: C12H9BrClNO3 Molecular Weight: 330.56
    ● In Stock — US warehouse, ships to EU* Item #: E358435
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    Technical Identifiers
    IUPAC Name
    ethyl 6-bromo-8-chloro-4-oxo-1H-quinoline-3-carboxylate
    SMILES
    CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2Cl)Br
    InChIKey
    MIAXLCWSDBLVNU-UHFFFAOYSA-N
    InChI
    1S/C12H9BrClNO3/c1-2-18-12(17)8-5-15-10-7(11(8)16)3-6(13)4-9(10)14/h3-5H,2H2,1H3,(H,15,16)
    Synonyms
    ETHYL6-BROMO-8-CHLORO-4-HYDROXY-QUINOLINE-3-CARBOXYLATE | Z1613072405 | CCG-234809 | Maybridge1_000758 | ethyl 6-brom...
  2. Ethyl 5-nitro-2-furoate
    CAS: 943-37-3 Formula: C7H7NO5 Molecular Weight: 185.13
    ● In Stock — US warehouse, ships to EU* Item #: E331028
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    Technical Identifiers
    IUPAC Name
    ethyl 5-nitrofuran-2-carboxylate
    SMILES
    CCOC(=O)C1=CC=C(O1)[N+](=O)[O-]
    InChIKey
    JMNXLAQKIHVFIC-UHFFFAOYSA-N
    InChI
    1S/C7H7NO5/c1-2-12-7(9)5-3-4-6(13-5)8(10)11/h3-4H,2H2,1H3
    Synonyms
    NSC54255 | 2-Furoic acid, 5-nitro-, ethyl ester | Ethyl 5-nitro-2-furoate | NSC38652 | NSC-38652 | SCHEMBL1167414 | e...
  3. Ethyl caffeate
    CAS: 102-37-4 Formula: C11H12O4 Molecular Weight: 208.21
    Liquid 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: E420378
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    IUPAC Name
    ethyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
    SMILES
    CCOC(=O)C=CC1=CC(=C(C=C1)O)O
    InChIKey
    WDKYDMULARNCIS-GQCTYLIASA-N
    InChI
    1S/C11H12O4/c1-2-15-11(14)6-4-8-3-5-9(12)10(13)7-8/h3-7,12-13H,2H2,1H3/b6-4+
    Synonyms
    4gqq | NSC619661 | NSC-619661 | ethyl 3-(3,4-dihydroxyphenyl)prop-2-enoate | (E)-ethyl caffeate | AC-34380 | HY-N6966...
  4. Ethyl caproate-d11
    CAS: 2159-19-5 Formula: C8H5D11O2 Molecular Weight: 155.28
    ● In Stock — US warehouse, ships to EU* Item #: E357732
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    Technical Identifiers
    IUPAC Name
    ethyl 2,2,3,3,4,4,5,5,6,6,6-undecadeuteriohexanoate
    SMILES
    CCCCCC(=O)OCC
    InChIKey
    SHZIWNPUGXLXDT-LELBNVJRSA-N
    InChI
    1S/C8H16O2/c1-3-5-6-7-8(9)10-4-2/h3-7H2,1-2H3/i1D3,3D2,5D2,6D2,7D2
    Synonyms
    Hexanoic Acid Ethyl Ester-d11 | Caproic Acid Ethyl Ester-d11 | Ethyl Caproate-d11
  5. Ethyl imidazo[2,1-b][1,3]benzothiazole-2-carboxylate
    CAS: 64951-05-9 Formula: C12H10N2O2S Molecular Weight: 246.29
    ● In Stock — US warehouse, ships to EU* Item #: E358663
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    IUPAC Name
    ethyl imidazo[2,1-b][1,3]benzothiazole-2-carboxylate
    SMILES
    CCOC(=O)C1=CN2C3=CC=CC=C3SC2=N1
    InChIKey
    REOXQBVMMDCPSB-UHFFFAOYSA-N
    InChI
    1S/C12H10N2O2S/c1-2-16-11(15)8-7-14-9-5-3-4-6-10(9)17-12(14)13-8/h3-7H,2H2,1H3
    Synonyms
    Benzo[d]imidazo[2,1-b]thiazole-2-carboxylic acid ethyl ester | MFCD00203009 | ethyl 7-thia-2,5-diazatricyclo[6.4.0.0^...
  6. Ethyl hydrogen suberate
    CAS: 14113-01-0 Formula: C10H18O2 Molecular Weight: 202.25
    ● In Stock — US warehouse, ships to EU* Item #: E330642
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    IUPAC Name
    8-ethoxy-8-oxooctanoic acid
    SMILES
    CCOC(=O)CCCCCCC(=O)O
    InChIKey
    KCFVQEAPUOVXTH-UHFFFAOYSA-N
    InChI
    1S/C10H18O4/c1-2-14-10(13)8-6-4-3-5-7-9(11)12/h2-8H2,1H3,(H,11,12)
    Synonyms
    EINECS 237-968-0 | Octanedioic acid,1-ethyl ester | 8-ethoxy-8-oxooctanoate | Ethyl hydrogen suberate | 8-ethoxy-8-ox...
  7. Ethyl cycloheptylacetate
    CAS: 80246-70-4 Formula: C11H20O2 Molecular Weight: 184.28
    ● In Stock — US warehouse, ships to EU* Item #: E358488
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    IUPAC Name
    ethyl 2-cycloheptylacetate
    SMILES
    CCOC(=O)CC1CCCCCC1
    InChIKey
    WBZGWMNNCXEKSC-UHFFFAOYSA-N
    InChI
    1S/C11H20O2/c1-2-13-11(12)9-10-7-5-3-4-6-8-10/h10H,2-9H2,1H3
    Synonyms
    cycloheptylaceticacidethylester | SCHEMBL2779505 | AKOS015840844 | Cycloheptaneacetic acid ethyl ester | Ethyl cycloh...
  8. Ethyl dibromoacetate
    CAS: 617-33-4 EC Number: 210-510-7 Formula: C4H6Br2O2 Molecular Weight: 245.9
    ● In Stock — US warehouse, ships to EU* Item #: E331036
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    Technical Identifiers
    IUPAC Name
    ethyl 2,2-dibromoacetate
    SMILES
    CCOC(=O)C(Br)Br
    InChIKey
    NIJGVVHCUXNSLL-UHFFFAOYSA-N
    InChI
    1S/C4H6Br2O2/c1-2-8-4(7)3(5)6/h3H,2H2,1H3
    Synonyms
    Acetic acid, dibromo-, ethyl ester | U57B34JKE5 | MFCD00041718 | AKOS028108567 | SY026437 | ethyl 2,2-dibromoacetate ...
  9. Ethyl β-Chlorolactate
    CAS: 40149-32-4 Formula: C5H9ClO3 Molecular Weight: 152.58
    ● In Stock — US warehouse, ships to EU* Item #: E357552
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    Technical Identifiers
    IUPAC Name
    ethyl 3-chloro-2-hydroxypropanoate
    SMILES
    CCOC(=O)C(CCl)O
    InChIKey
    AYXGLGKNUAYZPX-UHFFFAOYSA-N
    InChI
    1S/C5H9ClO3/c1-2-9-5(8)4(7)3-6/h4,7H,2-3H2,1H3
    Synonyms
    3-Chloro-2-hydroxy-Propanoic Acid Ethyl Ester
  10. Ethyl-2-(1H-1,2,4-triazole-1-yl)acetate
    CAS: 56563-01-0 Formula: C6H9N3O2 Molecular Weight: 155.16
    ● In Stock — US warehouse, ships to EU* Item #: E358677
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    Technical Identifiers
    IUPAC Name
    ethyl 2-(1,2,4-triazol-1-yl)acetate
    SMILES
    CCOC(=O)CN1C=NC=N1
    InChIKey
    KOXLIKDTQXSKIE-UHFFFAOYSA-N
    InChI
    1S/C6H9N3O2/c1-2-11-6(10)3-9-5-7-4-8-9/h4-5H,2-3H2,1H3
    Synonyms
    1H-1,2,4-triazol-1-acetic acid ethyl ester | J-504637 | DTXSID801299343 | ethyl (1,2,4-triazol-1-yl)acetate | MFCD002...
  11. Ethyl-3-(2,5-difluorophenyl)-3-oxo-propanoate
    CAS: 887267-53-0 Formula: C11H10F2O3 Molecular Weight: 228.2
    ● In Stock — US warehouse, ships to EU* Item #: E358240
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    Technical Identifiers
    IUPAC Name
    ethyl 3-(2,5-difluorophenyl)-3-oxopropanoate
    SMILES
    CCOC(=O)CC(=O)C1=C(C=CC(=C1)F)F
    InChIKey
    FLBIFWLBLQKDAE-UHFFFAOYSA-N
    InChI
    1S/C11H10F2O3/c1-2-16-11(15)6-10(14)8-5-7(12)3-4-9(8)13/h3-5H,2,6H2,1H3
    Synonyms
    C76968 | Ethyl 3-(2,5-difluorophenyl)-3-oxopropanoate | SCHEMBL2461202 | ETHYL 2,5-DIFLUOROBENZOYLACETATE | Ethyl 3-(...
  12. Ethynodiol diacetate, Progesterone receptor agonist
    CAS: 297-76-7 EC Number: 206-044-9 Formula: C24H32O4 Molecular Weight: 384.51
    Liquid 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 #: E408955
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    Synonyms
    8080 CB | 19-Norpregn-4-en-20-yne-3,17-diol, 3,17-diacetate, (3β,17α)-
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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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