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. Cortisone
    CAS: 53-06-5 EC Number: 200-162-4 Formula: C21H28O5 Molecular Weight: 360.44
    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 #: C424546
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    Technical Identifiers
    IUPAC Name
    (8S,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11-dione
    SMILES
    CC12CCC(=O)C=C1CCC3C2C(=O)CC4(C3CCC4(C(=O)CO)O)C
    InChIKey
    MFYSYFVPBJMHGN-ZPOLXVRWSA-N
    InChI
    1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14-,15-,18+,19-,20show more
    Synonyms
    DTXCID102857 | EN300-212934 | Tox21_301440 | MLS000028540 | MLS002207137 | HMS3260P21 | Prestwick_132 | Adrenalex | C...
  2. Crassicauline A
    CAS: 79592-91-9 PubChem CID: 157539 Formula: C35H49NO10 Molecular Weight: 643.76
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: C426025
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    IUPAC Name
    [8-acetyloxy-11-ethyl-5-hydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate
    SMILES
    CCN1CC2(CCC(C34C2C(C(C31)C5(CC(C6(CC4C5C6OC(=O)C7=CC=C(C=C7)OC)O)OC)OC(=O)C)OC)OC)COC
    InChIKey
    GAZDXIGXYWVWQX-UHFFFAOYSA-N
    InChI
    1S/C35H49NO10/c1-8-36-17-32(18-40-3)14-13-23(42-5)35-22-15-33(39)24(43-6)16-34(46-19(2)37,26(29(35)36)27(44-7)28(32)35)25(22)30(33)45-31(38)20-9-11-21show more
    Synonyms
    Crassicauline I | Crassicauline-A | 3-Deoxyyunaconitine;Crassicaulin A | DTXSID701000610 | s9398 | CCG-270323 | Bulle...
  3. Crassicauline A
    CAS: 79592-91-9 PubChem CID: 157539 Formula: C35H49NO10 Molecular Weight: 643.76
    ● In Stock — US warehouse, ships to EU* Item #: C414393
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    Technical Identifiers
    IUPAC Name
    [8-acetyloxy-11-ethyl-5-hydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate
    SMILES
    CCN1CC2(CCC(C34C2C(C(C31)C5(CC(C6(CC4C5C6OC(=O)C7=CC=C(C=C7)OC)O)OC)OC(=O)C)OC)OC)COC
    InChIKey
    GAZDXIGXYWVWQX-UHFFFAOYSA-N
    InChI
    1S/C35H49NO10/c1-8-36-17-32(18-40-3)14-13-23(42-5)35-22-15-33(39)24(43-6)16-34(46-19(2)37,26(29(35)36)27(44-7)28(32)35)25(22)30(33)45-31(38)20-9-11-21show more
    Synonyms
    Crassicauline I | Crassicauline-A | 3-Deoxyyunaconitine;Crassicaulin A | DTXSID701000610 | s9398 | CCG-270323 | Bulle...
  4. Cropropamide
    CAS: 633-47-6 Formula: C13H24N2O2 Molecular Weight: 240.34
    ◐ .Made to order · 8–12 wks Item #: C346589
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    IUPAC Name
    2-[[(E)-but-2-enoyl]-propylamino]-N,N-dimethylbutanamide
    SMILES
    CCCN(C(CC)C(=O)N(C)C)C(=O)C=CC
    InChIKey
    CYZWCBZIBJLKCV-RMKNXTFCSA-N
    InChI
    1S/C13H24N2O2/c1-6-9-12(16)15(10-7-2)11(8-3)13(17)14(4)5/h6,9,11H,7-8,10H2,1-5H3/b9-6+
    Synonyms
    CYZWCBZIBJLKCV-RMKNXTFCSA-N | CROPROPAMIDE | N-[1-[(Dimethylamino)carbonyl]propyl]-N-propyl-2-butenamide; N-[1-(dimet...
  5. Creatine Phosphate Sodium Salt
    CAS: 71519-72-7 EC Number: 682-473-9 Formula: C4H8N3Na2O5P·4H2O Molecular Weight: 327.14
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: C104990
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    Synonyms
    Sodium creatine phosphate dibasic tetrahydrate | Creatine phosphate disodium salt tetrahydrate
  6. Crizotinib
    CAS: 877399-52-5 EC Number: 638-814-9 Formula: C21H22Cl2FN5O Molecular Weight: 450.34
    Solid ≥99%
    ● In Stock — US warehouse, ships to EU* Item #: C137735
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    IUPAC Name
    3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine
    SMILES
    CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=C(N=CC(=C2)C3=CN(N=C3)C4CCNCC4)N
    InChIKey
    KTEIFNKAUNYNJU-GFCCVEGCSA-N
    InChI
    1S/C21H22Cl2FN5O/c1-12(19-16(22)2-3-17(24)20(19)23)30-18-8-13(9-27-21(18)25)14-10-28-29(11-14)15-4-6-26-7-5-15/h2-3,8-12,15,26H,4-7H2,1H3,(H2,25,27)/tshow more
    Synonyms
    PF02341066 | PF 2341066 | 1-[(2R,5R)-5-ethynyl-5-(hydroxymethyl)-2H-furan-2-yl]-5-methyl-pyrimidine-2,4-dione | NCGC0...
  7. Crizotinib (PF-02341066)
    CAS: 877399-52-5 EC Number: 638-814-9 Formula: C21H22Cl2FN5O Molecular Weight: 450.34
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: C408520
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    IUPAC Name
    3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine
    SMILES
    CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=C(N=CC(=C2)C3=CN(N=C3)C4CCNCC4)N
    InChIKey
    KTEIFNKAUNYNJU-GFCCVEGCSA-N
    InChI
    1S/C21H22Cl2FN5O/c1-12(19-16(22)2-3-17(24)20(19)23)30-18-8-13(9-27-21(18)25)14-10-28-29(11-14)15-4-6-26-7-5-15/h2-3,8-12,15,26H,4-7H2,1H3,(H2,25,27)/tshow more
    Synonyms
    1-[(2R,5R)-5-ethynyl-5-(hydroxymethyl)-2H-furan-2-yl]-5-methyl-pyrimidine-2,4-dione | NCGC00250400-09 | BB 0261738 | ...
  8. Crizotinib hydrochloride
    CAS: 1415560-69-8 Formula: C21H23Cl3FN5O Molecular Weight: 486.8
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: C421534
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    IUPAC Name
    3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine;hydrochloride
    SMILES
    CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=C(N=CC(=C2)C3=CN(N=C3)C4CCNCC4)N.Cl
    InChIKey
    BTDNHKQCPIBABF-UTONKHPSSA-N
    InChI
    1S/C21H22Cl2FN5O.ClH/c1-12(19-16(22)2-3-17(24)20(19)23)30-18-8-13(9-27-21(18)25)14-10-28-29(11-14)15-4-6-26-7-5-15;/h2-3,8-12,15,26H,4-7H2,1H3,(H2,25,show more
    Synonyms
    3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(piperidin-4-yl)-1H-pyrazol-4-yl]pyridin-2-amine hydrochloride | ...
  9. Crotamiton, Inhibitor of TRPV4
    CAS: 483-63-6 EC Number: 207-596-3 Formula: C13H17NO Molecular Weight: 203.28
    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 #: C407741
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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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