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

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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. Betazole Dihydrochloride
    CAS: 138-92-1 EC Number: 205-345-2 PubChem CID: 67412 Formula: C5H11Cl2N3 Molecular Weight: 184.07
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: B421467
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    IUPAC Name
    2-(1H-pyrazol-5-yl)ethanamine;dihydrochloride
    SMILES
    C1=C(NN=C1)CCN.Cl.Cl
    InChIKey
    BUXCUOWXTOKEMQ-UHFFFAOYSA-N
    InChI
    1S/C5H9N3.2ClH/c6-3-1-5-2-4-7-8-5;;/h2,4H,1,3,6H2,(H,7,8);2*1H
    Synonyms
    HY-B1557A | SR-01000841815-2 | 2-(3-PYRAZOLYL)ETHANAMINE 2HCL | 66ABP6C83F | Pyrazole, 3-(2-aminoethyl)-, dihydrochlo...
  2. Binimetinib (MEK162), Dual specificity mitogen-activated protein kinase kinase 2 inhibitor
    CAS: 606143-89-9 EC Number: 639-995-7 Formula: C17H15BrF2N4O3 Molecular Weight: 441.23
    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 #: B408532
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    ARRY-162,ARRY-438162 | 1H-Benzimidazole-6-carboxamide, 5-[(4-bromo-2-fluorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)...
  3. Bioymifi
    CAS: 1420071-30-2 EC Number: 809-115-8 Formula: C22H12BrN3O4S Molecular Weight: 494.32
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: B421554
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    IUPAC Name
    5-[5-[(Z)-[3-(4-bromophenyl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]isoindole-1,3-dione
    SMILES
    C1=CC(=CC=C1N2C(=O)C(=CC3=CC=C(O3)C4=CC5=C(C=C4)C(=O)NC5=O)SC2=N)Br
    InChIKey
    ULBOWKXOFOTCMU-NLDKGBHCSA-N
    InChI
    1S/C22H12BrN3O4S/c23-12-2-4-13(5-3-12)26-21(29)18(31-22(26)24)10-14-6-8-17(30-14)11-1-7-15-16(9-11)20(28)25-19(15)27/h1-10,24H,(H,25,27,28)/b18-10-,24show more
    Synonyms
    (Z)-5-(5-[(3-[4-Bromophenyl]-2-imino-4-oxothiazolidin-5-ylidene)methyl]furan-2-yl)isoindoline-1,3-dione | s7942 | 5-(...
  4. Biotin-maleimide
    CAS: 116919-18-7 Formula: C20H29N5O5S Molecular Weight: 451.54
    Solid ≥95%
    ● In Stock — US warehouse, ships to EU* Item #: B302263
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    IUPAC Name
    N'-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoyl]-6-(2,5-dioxopyrrol-1-yl)hexanehydrazide
    SMILES
    C1C2C(C(S1)CCCCC(=O)NNC(=O)CCCCCN3C(=O)C=CC3=O)NC(=O)N2
    InChIKey
    VAPZWEFPQRDVHR-NJSLBKSFSA-N
    InChI
    1S/C20H29N5O5S/c26-15(7-2-1-5-11-25-17(28)9-10-18(25)29)23-24-16(27)8-4-3-6-14-19-13(12-31-14)21-20(30)22-19/h9-10,13-14,19H,1-8,11-12H2,(H,23,26)(H,2show more
    Synonyms
    Biotin-maleimide | N'-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoyl]-6-(2,5-diox...
  5. Bimatoprost amide
    CAS: 155205-89-3 PubChem CID: 5283106 Formula: C23H33NO4 Molecular Weight: 387.51
    ● In Stock — US warehouse, ships to EU* Item #: B355681
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    IUPAC Name
    (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxy-5-phenylpent-1-enyl]cyclopentyl]hept-5-enamide
    SMILES
    C1C(C(C(C1O)C=CC(CCC2=CC=CC=C2)O)CC=CCCCC(=O)N)O
    InChIKey
    RAGQWYIPCPFTJC-KDACTHKWSA-N
    InChI
    1S/C23H33NO4/c24-23(28)11-7-2-1-6-10-19-20(22(27)16-21(19)26)15-14-18(25)13-12-17-8-4-3-5-9-17/h1,3-6,8-9,14-15,18-22,25-27H,2,7,10-13,16H2,(H2,24,28)show more
    Synonyms
    SR-01000946516 | 17-phenyl trinor Prostaglandin F2?? amide | CHEBI:169171 | 17-phenyl-trinor-PGF2alpha amide | AKOS04...
  6. BioE-1115
    CAS: 1268863-35-9 Formula: C19H18FN3O2 Molecular Weight: 339.36
    ● In Stock — US warehouse, ships to EU* Item #: B412674
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    IUPAC Name
    2-(4-fluorophenyl)-3-[methyl(propan-2-yl)amino]quinoxaline-6-carboxylic acid
    SMILES
    CC(C)N(C)C1=NC2=C(C=CC(=C2)C(=O)O)N=C1C3=CC=C(C=C3)F
    InChIKey
    JKKRYYTVQXUOKL-UHFFFAOYSA-N
    InChI
    1S/C19H18FN3O2/c1-11(2)23(3)18-17(12-4-7-14(20)8-5-12)21-15-9-6-13(19(24)25)10-16(15)22-18/h4-11H,1-3H3,(H,24,25)
    Synonyms
    6-​Quinoxalinecarboxyli​c acid
  7. Biotin 5-Bromopentylamide
    CAS: 1217605-72-5 PubChem CID: 71433555 Formula: C15H26BrN3O2S Molecular Weight: 392.35
    Solid ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: B340906
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    Technical Identifiers
    IUPAC Name
    5-[(3aR,4S,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-(5-bromopentyl)pentanamide
    SMILES
    C1C2C(C(S1)CCCCC(=O)NCCCCCBr)NC(=O)N2
    InChIKey
    BBMKEQZLWUFNDA-MBNYWOFBSA-N
    InChI
    1S/C15H26BrN3O2S/c16-8-4-1-5-9-17-13(20)7-3-2-6-12-14-11(10-22-12)18-15(21)19-14/h11-12,14H,1-10H2,(H,17,20)(H2,18,19,21)/t11-,12+,14-/m1/s1
    Synonyms
    N-Biotinyl-5-bromopentylamine
  8. Bifonazole, HMG-CoA reductase inhibitor
    CAS: 60628-96-8 EC Number: 262-336-6 Formula: C22H18N2 Molecular Weight: 310.39
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: B407805
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    Synonyms
    Bay h 4502 | 1-​([1,​1'-​biphenyl]​-​4-​ylphenylmethyl)​-1H-​imidazole
  9. Bilastine, Histamine H1 receptor inverse agonist
    CAS: 202189-78-4 EC Number: 824-988-5 Formula: C28H37N3O3 Molecular Weight: 463.62
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 2mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: B422458
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    IUPAC Name
    2-[4-[2-[4-[1-(2-ethoxyethyl)benzimidazol-2-yl]piperidin-1-yl]ethyl]phenyl]-2-methylpropanoic acid
    SMILES
    CCOCCN1C2=CC=CC=C2N=C1C3CCN(CC3)CCC4=CC=C(C=C4)C(C)(C)C(=O)O
    InChIKey
    ACCMWZWAEFYUGZ-UHFFFAOYSA-N
    InChI
    1S/C28H37N3O3/c1-4-34-20-19-31-25-8-6-5-7-24(25)29-26(31)22-14-17-30(18-15-22)16-13-21-9-11-23(12-10-21)28(2,3)27(32)33/h5-12,22H,4,13-20H2,1-3H3,(H,3show more
    Synonyms
    Bilastine|202189-78-4|Bilaxten|Ilaxten|Bilastine [INN]|2-[4-[2-[4-[1-(2-ethoxyethyl)benzimidazol-2-yl]piperidin-1-yl]...
  10. Biotite
    CAS: 12001-26-2 EC Number: 601-648-2 Formula: K2O.3Al2O3.6SiO2∙2H2O Molecular Weight: 796.65(760.62anhy)
    100 mesh
    ◐ .Made to order · 8–12 wks Item #: B302554
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    IUPAC Name
    dipotassium;dioxosilane;oxo(oxoalumanyloxy)alumane;oxygen(2-)
    SMILES
    [O-2].O=[Al]O[Al]=O.O=[Si]=O.[K+].[K+]
    InChIKey
    YGANSGVIUGARFR-UHFFFAOYSA-N
    InChI
    1S/2Al.2K.O2Si.4O/c;;;;1-3-2;;;;/q;;2*+1;;;;;-2
    Synonyms
    Muscovite|12001-26-2|Chacaltaite|Astrolit|Astrolite|Cogemika|Serikuron|Fluorian muscovite|Muscovite, fluorian|Clarite...
  11. BioE-1115
    CAS: 1268863-35-9 Formula: C19H18FN3O2 Molecular Weight: 339.36
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: B421115
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    IUPAC Name
    2-(4-fluorophenyl)-3-[methyl(propan-2-yl)amino]quinoxaline-6-carboxylic acid
    SMILES
    CC(C)N(C)C1=NC2=C(C=CC(=C2)C(=O)O)N=C1C3=CC=C(C=C3)F
    InChIKey
    JKKRYYTVQXUOKL-UHFFFAOYSA-N
    InChI
    1S/C19H18FN3O2/c1-11(2)23(3)18-17(12-4-7-14(20)8-5-12)21-15-9-6-13(19(24)25)10-16(15)22-18/h4-11H,1-3H3,(H,24,25)
    Synonyms
    6-​Quinoxalinecarboxyli​c acid
  12. Biochanin A
    CAS: 491-80-5 EC Number: 207-744-7 Formula: C16H12O5 Molecular Weight: 284.26
    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 #: B408800
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    Synonyms
    4-Methylgenistein | 4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(4-methoxyphenyl)-
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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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