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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136,976 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 (where available)—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. Acetylcholine chloride(ACh)
    CAS: 60-31-1 EC Number: 200-468-8 Formula: C7H16ClNO2 Molecular Weight: 181.66
    ● In Stock — US warehouse, ships to EU* Item #: A111014
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    Technical Identifiers
    IUPAC Name
    2-acetyloxyethyl(trimethyl)azanium;chloride
    SMILES
    CC(=O)OCC[N+](C)(C)C.[Cl-]
    InChIKey
    JUGOREOARAHOCO-UHFFFAOYSA-M
    InChI
    1S/C7H16NO2.ClH/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1
    Synonyms
    ACh | MLS000028640 | NCGC00018123-07 | SCHEMBL40885 | Acetylcholine chloride (USP:INN:BAN:JAN) | Acetylcholine hydroc...
  2. Acetylcholine chloride(ACh), Muscarinic acetylcholine receptor M3 agonist
    CAS: 60-31-1 EC Number: 200-468-8 Formula: C7H16ClNO2 Molecular Weight: 181.66
    for Cell culture ? Cell-culture grade — low endotoxin and contaminants to support viable cell growth. Use in mammalian/other cell culture media and supplements. ≥99%
    ● In Stock — US warehouse, ships to EU* Item #: A111015
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    Technical Identifiers
    IUPAC Name
    2-acetyloxyethyl(trimethyl)azanium;chloride
    SMILES
    CC(=O)OCC[N+](C)(C)C.[Cl-]
    InChIKey
    JUGOREOARAHOCO-UHFFFAOYSA-M
    InChI
    1S/C7H16NO2.ClH/c1-7(9)10-6-5-8(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1
    Synonyms
    MLS000028640 | NCGC00018123-07 | SCHEMBL40885 | Acetylcholine chloride (USP:INN:BAN:JAN) | Acetylcholine hydrochlorid...
  3. Moxidectin
    CAS: 113507-06-5 Formula: C37H53NO8 Molecular Weight: 639.82
    ● In Stock — US warehouse, ships to EU* Item #: M305308
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    IUPAC Name
    (1R,4S,4'E,5'S,6R,6'S,8R,10E,13R,14E,16E,20R,21R,24S)-21,24-dihydroxy-4'-methoxyimino-5',11,13,22-tetramethyl-6'-[(E)-4-methylpent-2-en-2-yl]spiro[3,7show more
    SMILES
    CC1CC(=CCC2CC(CC3(O2)CC(=NOC)C(C(O3)C(=CC(C)C)C)C)OC(=O)C4C=C(C(C5C4(C(=CC=C1)CO5)O)O)C)C
    InChIKey
    YZBLFMPOMVTDJY-LSGXYNIPSA-N
    InChI
    1S/C37H53NO8/c1-21(2)14-25(6)33-26(7)31(38-42-8)19-36(46-33)18-29-17-28(45-36)13-12-23(4)15-22(3)10-9-11-27-20-43-34-32(39)24(5)16-30(35(40)44-29)37(2show more
    Synonyms
    (2R,3S,4R,5R)-2-Hydroxymethyl-5-(6-methylamino-purin-9-yl)-tetrahydro-furan-3,4-diol | Milbemycin B, 5-O-demethyl-28-...
  4. Papain Inhibitor TFA
    CAS: 70195-20-9(free basis) Formula: C19H29N7O6(free basis) Molecular Weight: 451.48(free basis)
    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%
    ● In Stock — US warehouse, ships to EU* Item #: P276460
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    Synonyms
    GGYR TFA, Glycyl-glycyl-tyrosyl-arginine TFA
  5. Papaverine hydrochloride
    CAS: 61-25-6 EC Number: 200-502-1 Formula: C20H22ClNO4 Molecular Weight: 375.86
    ● In Stock — US warehouse, ships to EU* Item #: P275480
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    IUPAC Name
    1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline;hydrochloride
    SMILES
    COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.Cl
    InChIKey
    UOTMYNBWXDUBNX-UHFFFAOYSA-N
    InChI
    1S/C20H21NO4.ClH/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16;/h5-8,10-12H,9H2,1-4H3;1H
    Synonyms
    Chlorhydrate de papaverine | Pavabid | Pavagrant | Qua bid | Tox21_110226 | Tox21_110226_1 | CCG-40065 | Papavarine h...
  6. Acetylsalicylic acid(ASA), Cyclooxygenase inhibitor
    CAS: 50-78-2 EC Number: 200-064-1 Formula: C9H8O4 Molecular Weight: 180.16
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
    ● In Stock — US warehouse, ships to EU* Item #: A104180
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    IUPAC Name
    2-acetyloxybenzoic acid
    SMILES
    CC(=O)OC1=CC=CC=C1C(=O)O
    InChIKey
    BSYNRYMUTXBXSQ-UHFFFAOYSA-N
    InChI
    1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)
    Synonyms
    ASA | Acesal | Acetisal | Aspirdrops | Solpyron | A.S.A. empirin | Acetosal | Benaspir | Contrheuma retard | Acido ac...
  7. Galanthamine N-Oxide
    CAS: 134332-50-6 EC Number: 682-869-1 Formula: C17H21NO4 Molecular Weight: 303.35
    ● In Stock — US warehouse, ships to EU* Item #: G342548
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    IUPAC Name
    (1S,12S,14R)-9-methoxy-4-methyl-4-oxido-11-oxa-4-azoniatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-ol
    SMILES
    C[N+]1(CCC23C=CC(CC2OC4=C(C=CC(=C34)C1)OC)O)[O-]
    InChIKey
    LROQBKNDGTWXET-FVWDGWMTSA-N
    InChI
    1S/C17H21NO4/c1-18(20)8-7-17-6-5-12(19)9-14(17)22-16-13(21-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-,18?/m0/s1
    Synonyms
    Galanthamine 10-Oxide(Galanthamine N-Oxide) | UNII-S6AF61T5WO | Galantamine N-Oxide | SCHEMBL3299153 | LROQBKNDGTWXET...
  8. Lauryl ether sulfate sodium
    CAS: 68585-34-2 EC Number: 500-223-8 Formula: C12H25(CH2CH2O)nSO4Na
    70%
    ● In Stock — Germany Item #: S304383
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    IUPAC Name
    disodium;1-dodecoxydodecane;sulfate
    SMILES
    CCCCCCCCCCCCOCCCCCCCCCCCC.[O-]S(=O)(=O)[O-].[Na+].[Na+]
    InChIKey
    SMVRDGHCVNAOIN-UHFFFAOYSA-L
    InChI
    1S/C24H50O.2Na.H2O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2;;;1-5(2,3)4/h3-24H2,1-2H3;;;(H2,1,2,3,4)/q;2*+1;/p-2
    Synonyms
    lauryl ether sulfate sodium|68585-34-2|disodium;1-dodecoxydodecane;sulfate|1335-72-4|Sodiumlaurylethersulfate|SMVRDGH...
  9. Lazabemide hydrochloride
    CAS: 103878-83-7 Formula: C8H10ClN3O.HCl Molecular Weight: 236.1
    ● In Stock — US warehouse, ships to EU* Item #: L287023
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    Technical Identifiers
    IUPAC Name
    N-(2-aminoethyl)-5-chloropyridine-2-carboxamide;hydrochloride
    SMILES
    C1=CC(=NC=C1Cl)C(=O)NCCN.Cl
    InChIKey
    JMFKTFLARGGXCC-UHFFFAOYSA-N
    InChI
    1S/C8H10ClN3O.ClH/c9-6-1-2-7(12-5-6)8(13)11-4-3-10;/h1-2,5H,3-4,10H2,(H,11,13);1H
    Synonyms
    Lazabemide hydrochloride | Lazabemidehydrochloride | Tox21_112582_1 | Lazabemide (hydrochloride) | AKOS024457114 | LA...
  10. Adefovir, DNA polymerase/reverse transcriptase inhibitor
    CAS: 106941-25-7 EC Number: 600-789-7 Formula: C8H12N5O4P Molecular Weight: 273.19
    ● In Stock — US warehouse, ships to EU* Item #: A165714
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    Technical Identifiers
    IUPAC Name
    2-(6-aminopurin-9-yl)ethoxymethylphosphonic acid
    SMILES
    C1=NC(=C2C(=N1)N(C=N2)CCOCP(=O)(O)O)N
    InChIKey
    SUPKOOSCJHTBAH-UHFFFAOYSA-N
    InChI
    1S/C8H12N5O4P/c9-7-6-8(11-3-10-7)13(4-12-6)1-2-17-5-18(14,15)16/h3-4H,1-2,5H2,(H2,9,10,11)(H2,14,15,16)
    Synonyms
    Phosphonic acid, ((2-6-amino-9H-purin-9-YL)ethoxy)methyl | ADEFOVIR [WHO-DD] | DB13868 | ((2-6-amino-9H-purin-9-yl) e...
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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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