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. Co 101244 hydrochloride
    CAS: 193356-17-1 Formula: C21H27NO3•HCl Molecular Weight: 377.9
    ● In Stock — US warehouse, ships to EU* Item #: C288405
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    Technical Identifiers
    IUPAC Name
    1-[2-(4-hydroxyphenoxy)ethyl]-4-[(4-methylphenyl)methyl]piperidin-4-ol;hydrochloride
    SMILES
    CC1=CC=C(C=C1)CC2(CCN(CC2)CCOC3=CC=C(C=C3)O)O.Cl
    InChIKey
    WFFZHKKSIDENAJ-UHFFFAOYSA-N
    InChI
    1S/C21H27NO3.ClH/c1-17-2-4-18(5-3-17)16-21(24)10-12-22(13-11-21)14-15-25-20-8-6-19(23)7-9-20;/h2-9,23-24H,10-16H2,1H3;1H
    Synonyms
    PD 174494, Ro 63-1908 | 1-[2-(4-Hydroxyphenoxy)ethyl]-4-[(4-methylphenyl)methyl]-4-piperidinol hydrochloride | 1-(2-(...
  2. Co 102862
    CAS: 181144-66-1 Formula: C14H12FN3O2 Molecular Weight: 273.3
    ● In Stock — US warehouse, ships to EU* Item #: C274997
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    IUPAC Name
    [(E)-[4-(4-fluorophenoxy)phenyl]methylideneamino]urea
    SMILES
    C1=CC(=CC=C1C=NNC(=O)N)OC2=CC=C(C=C2)F
    InChIKey
    MHUUDVZSPFRUSK-RQZCQDPDSA-N
    InChI
    1S/C14H12FN3O2/c15-11-3-7-13(8-4-11)20-12-5-1-10(2-6-12)9-17-18-14(16)19/h1-9H,(H3,16,18,19)/b17-9+
    Synonyms
    NCGC00167807-01 | BCP32511 | J-011566 | HMS3677N07 | MS-23875 | FPhOBal semicarbazone | 0KN11H90GF | 2-(4-(4-Fluoroph...
  3. Conivaptan HCl, ADH V1a receptor antagonist
    CAS: 168626-94-6 EC Number: 111-171-7 Formula: C32H26N4O2·HCl Molecular Weight: 535.04
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: C408569
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    Synonyms
    N-​[4-​[(4,​5-​dihydro-​2-​methylimidazo[4,​5-​d]​[1]​benzazepin-​6(1H)​-​yl)​carbonyl]​phenyl]​-[1,​1'-​biphenyl]​-​2-...
  4. Copper bis-3,5-diisopropylsalicylate
    CAS: 21246-18-4 PubChem CID: 54689798 Formula: C26H34CuO6 Molecular Weight: 506.09
    ◐ .Made to order · 8–12 wks Item #: C276480
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    IUPAC Name
    copper;2-carboxy-4,6-di(propan-2-yl)phenolate
    SMILES
    CC(C)C1=CC(=C(C(=C1)C(=O)O)[O-])C(C)C.CC(C)C1=CC(=C(C(=C1)C(=O)O)[O-])C(C)C.[Cu+2]
    InChIKey
    TVBRFTMKVUPWQT-UHFFFAOYSA-L
    InChI
    1S/2C13H18O3.Cu/c2*1-7(2)9-5-10(8(3)4)12(14)11(6-9)13(15)16;/h2*5-8,14H,1-4H3,(H,15,16);/q;;+2/p-2
    Synonyms
    Copper, bis(2-hydroxy-3,5-bis(1-methylethyl)benzoato-O(sup 1),O(sup 2))-, (SP-4-1)- | CCRIS 3282 | AKOS022170246 | Co...
  5. Copper citrate
    CAS: 866-82-0 EC Number: 212-752-9 Formula: C6H8Cu2O7 Molecular Weight: 319.21
    Solid Cu>36%
    ● In Stock — Germany Item #: C304798
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    IUPAC Name
    dicopper;2-hydroxypropane-1,2,3-tricarboxylic acid
    SMILES
    C(C(=O)O)C(CC(=O)O)(C(=O)O)O.[Cu+2].[Cu+2]
    InChIKey
    XKKOEIQWOHLHQM-UHFFFAOYSA-N
    InChI
    1S/C6H8O7.2Cu/c7-3(8)1-6(13,5(11)12)2-4(9)10;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;/q;2*+2
    Synonyms
    866-82-0|Copper citrate|Cupric citrate|MFCD00050820|FT-0624061|dicopper;2-hydroxypropane-1,2,3-tricarboxylic acid
  6. Copper molybdenum oxide
    CAS: 13767-34-5 EC Number: 237-378-3 Formula: CuMoO₄ Molecular Weight: 223.48
    ● In Stock — US warehouse, ships to EU* Item #: C348933
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    Synonyms
    Copper molybdenum oxide | Copper(II) molybdate | COPPER MOLYBDATE(VI) (CU(MOO4)) | CUPRIC MOLYBDATE | Copper molybdat...
  7. Colforsin (Forskolin, HL 362)
    CAS: 66575-29-9 EC Number: 266-410-9 Formula: C22H34O7 Molecular Weight: 410.5
    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 #: C409070
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    Synonyms
    Coleonol, Colforsin | 1H-Naphtho[2,1-b]pyran-1-one, 5-(acetyloxy)-3-ethenyldodecahydro-6,10,10b-trihydroxy-3,4a,7,7,1...
  8. Columbamine
    CAS: 3621-36-1 Formula: C20H20NO4 Molecular Weight: 338.38
    Solid ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: C303549
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    IUPAC Name
    3,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2-ol
    SMILES
    COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)OC)O)OC
    InChIKey
    YYFOFDHQVIODOQ-UHFFFAOYSA-O
    InChI
    1S/C20H19NO4/c1-23-18-5-4-12-8-16-14-10-17(22)19(24-2)9-13(14)6-7-21(16)11-15(12)20(18)25-3/h4-5,8-11H,6-7H2,1-3H3/p+1
    Synonyms
    Columbamine|3621-36-1|Dehydroisocorypalmine|3,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2-ol|7T...
  9. Columbin
    CAS: 546-97-4 Formula: C20H22O6 Molecular Weight: 358.39
    ● In Stock — US warehouse, ships to EU* Item #: C414348
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    Technical Identifiers
    IUPAC Name
    (1R,2S,3S,5S,8R,11R,12R)-5-(furan-3-yl)-12-hydroxy-3,11-dimethyl-6,14-dioxatetracyclo[10.2.2.02,11.03,8]hexadec-15-ene-7,13-dione
    SMILES
    CC12CCC3C(=O)OC(CC3(C1C4C=CC2(C(=O)O4)O)C)C5=COC=C5
    InChIKey
    AALLCALQGXXWNA-QJNFORGASA-N
    InChI
    1S/C20H22O6/c1-18-9-14(11-5-8-24-10-11)25-16(21)12(18)3-6-19(2)15(18)13-4-7-20(19,23)17(22)26-13/h4-5,7-8,10,12-15,23H,3,6,9H2,1-2H3/t12-,13+,14-,15-,show more
    Synonyms
    (1R,2S,3S,5S,8R,11R,12R)-5-(Furan-3-yl)-12-hydroxy-3,11-dimethyl-6,14-dioxatetracyclo[10.2.2.02,11.03,8]hexadec-15-en...
  10. Columbin
    CAS: 546-97-4 Formula: C20H22O6 Molecular Weight: 358.39
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: C424659
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    Technical Identifiers
    IUPAC Name
    (1R,2S,3S,5S,8R,11R,12R)-5-(furan-3-yl)-12-hydroxy-3,11-dimethyl-6,14-dioxatetracyclo[10.2.2.02,11.03,8]hexadec-15-ene-7,13-dione
    SMILES
    CC12CCC3C(=O)OC(CC3(C1C4C=CC2(C(=O)O4)O)C)C5=COC=C5
    InChIKey
    AALLCALQGXXWNA-QJNFORGASA-N
    InChI
    1S/C20H22O6/c1-18-9-14(11-5-8-24-10-11)25-16(21)12(18)3-6-19(2)15(18)13-4-7-20(19,23)17(22)26-13/h4-5,7-8,10,12-15,23H,3,6,9H2,1-2H3/t12-,13+,14-,15-,show more
    Synonyms
    (1R,2S,3S,5S,8R,11R,12R)-5-(Furan-3-yl)-12-hydroxy-3,11-dimethyl-6,14-dioxatetracyclo[10.2.2.02,11.03,8]hexadec-15-en...
  11. Coluracetam
    CAS: 135463-81-9 Formula: C19H23N3O3 Molecular Weight: 341.4
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: C421348
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    Technical Identifiers
    IUPAC Name
    N-(2,3-dimethyl-5,6,7,8-tetrahydrofuro[2,3-b]quinolin-4-yl)-2-(2-oxopyrrolidin-1-yl)acetamide
    SMILES
    CC1=C(OC2=NC3=C(CCCC3)C(=C12)NC(=O)CN4CCCC4=O)C
    InChIKey
    PSPGQHXMUKWNDI-UHFFFAOYSA-N
    InChI
    1S/C19H23N3O3/c1-11-12(2)25-19-17(11)18(13-6-3-4-7-14(13)20-19)21-15(23)10-22-9-5-8-16(22)24/h3-10H2,1-2H3,(H,20,21,23)
    Synonyms
    Coluracetam|135463-81-9|N-(2,3-dimethyl-5,6,7,8-tetrahydrofuro[2,3-b]quinolin-4-yl)-2-(2-oxopyrrolidin-1-yl)acetamide...
  12. Complanatoside A
    CAS: 146501-37-3 PubChem CID: 101682254 Formula: C27H30O18 Molecular Weight: 642.52
    Liquid 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: C421697
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    Technical Identifiers
    IUPAC Name
    2-[3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydrshow more
    SMILES
    C1=C(C=C(C(=C1O)OC2C(C(C(C(O2)CO)O)O)O)O)C3=C(C(=O)C4=C(C=C(C=C4O3)O)O)OC5C(C(C(C(O5)CO)O)O)O
    InChIKey
    LLVOJEYSNCNXJN-XUAXIHHBSA-N
    InChI
    1S/C27H30O18/c28-5-13-16(34)19(37)21(39)26(42-13)44-24-10(32)1-7(2-11(24)33)23-25(18(36)15-9(31)3-8(30)4-12(15)41-23)45-27-22(40)20(38)17(35)14(6-29)4show more
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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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