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. AZ-33
    CAS: 1370290-34-8 Formula: C25H27N3O6S Molecular Weight: 497.56
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: A421406
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    IUPAC Name
    2-[[4-[4-[[3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-oxopropyl]amino]-4-oxobutyl]phenyl]methyl]propanedioic acid
    SMILES
    CC1=NC2=C(S1)C=C(C=C2)NC(=O)CCNC(=O)CCCC3=CC=C(C=C3)CC(C(=O)O)C(=O)O
    InChIKey
    SGFJAJFBGVAOFW-UHFFFAOYSA-N
    InChI
    1S/C25H27N3O6S/c1-15-27-20-10-9-18(14-21(20)35-15)28-23(30)11-12-26-22(29)4-2-3-16-5-7-17(8-6-16)13-19(24(31)32)25(33)34/h5-10,14,19H,2-4,11-13H2,1H3,show more
    Synonyms
    LDHA Inhibitor 33Propanedioic acid,2-​[[4-​[4-​[[3-​[(2-​methyl-​6-​benzothiazolyl)​amino]​-​3-​oxopropyl]​amino]​-​4-�...
  2. AZD8055, Serine/threonine-protein kinase mTOR inhibitor
    CAS: 1009298-09-2 EC Number: 836-652-5 Formula: C25H31N5O4 Molecular Weight: 465.56
    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 #: A408287
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    Synonyms
    (5-(2,4-bis((S)-3-methylmorpholino)pyrido[2,3-d]pyrimidin-7-yl)-2-methoxyphenyl)methanol
  3. AZD8330, Dual specificity mitogen-activated protein kinase kinase 2 inhibitor
    CAS: 869357-68-6 EC Number: 642-441-7 Formula: C16H17FIN3O4 Molecular Weight: 461.23
    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 #: A409124
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    Synonyms
    ARRY704 | 2-(2-fluoro-4-iodophenylamino)-N-(2-hydroxyethoxy)-1,5-dimethyl-6-oxo-1,6-dihydropyridine-3-carboxamide
  4. AZD8835, Inhibitor of phosphatidylinositol-4;5-bisphosphate 3-kinase catalytic subunit alpha;Inhibitor of phosphatidylinositol-4;5-bisphosphate 3-kinase catalytic subunit beta;Inhibitor of phosphatidylinositol-4;5-bisphosphate 3-kinase catalytic subunit delta;Inhi
    CAS: 1620576-64-8 EC Number: 829-551-2 Formula: C22H31N9O3 Molecular Weight: 469.54
    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 #: A421963
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    IUPAC Name
    1-[4-[5-[5-amino-6-(5-tert-butyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]-1-ethyl-1,2,4-triazol-3-yl]piperidin-1-yl]-3-hydroxypropan-1-one
    SMILES
    CCN1C(=NC(=N1)C2CCN(CC2)C(=O)CCO)C3=CN=C(C(=N3)C4=NN=C(O4)C(C)(C)C)N
    InChIKey
    ZGRDYKFVDCFJCZ-UHFFFAOYSA-N
    InChI
    1S/C22H31N9O3/c1-5-31-19(26-18(29-31)13-6-9-30(10-7-13)15(33)8-11-32)14-12-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h12-13,32H,5-11H2,1-4H3,(H2,23show more
    Synonyms
    BDBM185362 | UNII-8B97A88D35 | CCG-269444 | compound 25 [PMID: 26475521] | NCGC00484075-01 | 1-(4-{5-[5-amino-6-(5-te...
  5. AZD9496
    CAS: 1639042-08-2 Formula: C25H25F3N2O2 Molecular Weight: 442.47
    ● In Stock — US warehouse, ships to EU* Item #: A413988
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    IUPAC Name
    (E)-3-[3,5-difluoro-4-[(1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]phenyl]prop-2-enoic acid
    SMILES
    CC1CC2=C(C(N1CC(C)(C)F)C3=C(C=C(C=C3F)C=CC(=O)O)F)NC4=CC=CC=C24
    InChIKey
    DFBDRVGWBHBJNR-BBNFHIFMSA-N
    InChI
    1S/C25H25F3N2O2/c1-14-10-17-16-6-4-5-7-20(16)29-23(17)24(30(14)13-25(2,3)28)22-18(26)11-15(12-19(22)27)8-9-21(31)32/h4-9,11-12,14,24,29H,10,13H2,1-3H3show more
    Synonyms
    NN(2)-acetyl-L-glutamine | EX-A1326 | AZD 9496 [WHO-DD] | HY-12870 | SMR003500718 | DB15138 | MFCD28902195 | Q2746193...
  6. AZD9496
    CAS: 1639042-08-2 Formula: C25H25F3N2O2 Molecular Weight: 442.47
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: A422020
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    Technical Identifiers
    IUPAC Name
    (E)-3-[3,5-difluoro-4-[(1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]phenyl]prop-2-enoic acid
    SMILES
    CC1CC2=C(C(N1CC(C)(C)F)C3=C(C=C(C=C3F)C=CC(=O)O)F)NC4=CC=CC=C24
    InChIKey
    DFBDRVGWBHBJNR-BBNFHIFMSA-N
    InChI
    1S/C25H25F3N2O2/c1-14-10-17-16-6-4-5-7-20(16)29-23(17)24(30(14)13-25(2,3)28)22-18(26)11-15(12-19(22)27)8-9-21(31)32/h4-9,11-12,14,24,29H,10,13H2,1-3H3show more
    Synonyms
    AZD9496|1639042-08-2|AZD-9496|(E)-3-(3,5-difluoro-4-((1R,3R)-2-(2-fluoro-2-methylpropyl)-3-methyl-2,3,4,9-tetrahydro-...
  7. Camizestrant, Estrogen receptor alpha degrader
    CAS: 2222844-89-3 Formula: C24H28F4N6 Molecular Weight: 476.51
    ● In Stock — US warehouse, ships to EU* Item #: A414295
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    IUPAC Name
    N-[1-(3-fluoropropyl)azetidin-3-yl]-6-[(6S,8R)-8-methyl-7-(2,2,2-trifluoroethyl)-3,6,8,9-tetrahydropyrazolo[4,3-f]isoquinolin-6-yl]pyridin-3-amine
    SMILES
    CC1CC2=C(C=CC3=C2C=NN3)C(N1CC(F)(F)F)C4=NC=C(C=C4)NC5CN(C5)CCCF
    InChIKey
    WDHOIABIERMLGY-CMJOXMDJSA-N
    InChI
    1S/C24H28F4N6/c1-15-9-19-18(4-6-21-20(19)11-30-32-21)23(34(15)14-24(26,27)28)22-5-3-16(10-29-22)31-17-12-33(13-17)8-2-7-25/h3-6,10-11,15,17,23,31H,2,7show more
    Synonyms
    AZD9833 | AZD-9833 | N-[1-(3-fluoropropyl)azetidin-3-yl]-6-[(6S,8R)-8-methyl-7-(2,2,2-trifluoroethyl)-3,6,8,9-tetrahy...
  8. AZD2858, Inhibitor of glycogen synthase kinase 3 beta
    CAS: 486424-20-8 EC Number: 690-692-6 Formula: C21H23N7O3S Molecular Weight: 453.52
    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 #: A424211
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    IUPAC Name
    3-amino-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-pyridin-3-ylpyrazine-2-carboxamide
    SMILES
    CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CN=C(C(=N3)C(=O)NC4=CN=CC=C4)N
    InChIKey
    FHCSBLWRGCOVPT-UHFFFAOYSA-N
    InChI
    1S/C21H23N7O3S/c1-27-9-11-28(12-10-27)32(30,31)17-6-4-15(5-7-17)18-14-24-20(22)19(26-18)21(29)25-16-3-2-8-23-13-16/h2-8,13-14H,9-12H2,1H3,(H2,22,24)(Hshow more
    Synonyms
    A871895 | 3-amino-6-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-N-3-pyridinyl-2-pyrazinecarboxamide | AC-30277 | 3-a...
  9. AZD2932
    CAS: 883986-34-3 Formula: C24H25N5O4 Molecular Weight: 447.49
    ● In Stock — US warehouse, ships to EU* Item #: A413703
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    Technical Identifiers
    IUPAC Name
    2-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-N-(1-propan-2-ylpyrazol-4-yl)acetamide
    SMILES
    CC(C)N1C=C(C=N1)NC(=O)CC2=CC=C(C=C2)OC3=NC=NC4=CC(=C(C=C43)OC)OC
    InChIKey
    TWYCZJMOEMMCGC-UHFFFAOYSA-N
    InChI
    1S/C24H25N5O4/c1-15(2)29-13-17(12-27-29)28-23(30)9-16-5-7-18(8-6-16)33-24-19-10-21(31-3)22(32-4)11-20(19)25-14-26-24/h5-8,10-15H,9H2,1-4H3,(H,28,30)
    Synonyms
    AZD2932 | AZD-2932 | MS-28100 | A14156 | AC-33005 | 2-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-N-(1-propan-2-ylpyr...
  10. AZD2932
    CAS: 883986-34-3 Formula: C24H25N5O4 Molecular Weight: 447.49
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: A426675
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    Technical Identifiers
    IUPAC Name
    2-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-N-(1-propan-2-ylpyrazol-4-yl)acetamide
    SMILES
    CC(C)N1C=C(C=N1)NC(=O)CC2=CC=C(C=C2)OC3=NC=NC4=CC(=C(C=C43)OC)OC
    InChIKey
    TWYCZJMOEMMCGC-UHFFFAOYSA-N
    InChI
    1S/C24H25N5O4/c1-15(2)29-13-17(12-27-29)28-23(30)9-16-5-7-18(8-6-16)33-24-19-10-21(31-3)22(32-4)11-20(19)25-14-26-24/h5-8,10-15H,9H2,1-4H3,(H,28,30)
    Synonyms
    AZD2932 | AZD-2932 | MS-28100 | A14156 | AC-33005 | 2-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-N-(1-propan-2-ylpyr...
  11. AZD3229
    CAS: 2248003-60-1 Formula: C24H26FN7O3 Molecular Weight: 479.51
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: A422705
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    Technical Identifiers
    IUPAC Name
    N-[4-[[5-fluoro-7-(2-methoxyethoxy)quinazolin-4-yl]amino]phenyl]-2-(4-propan-2-yltriazol-1-yl)acetamide
    SMILES
    CC(C)C1=CN(N=N1)CC(=O)NC2=CC=C(C=C2)NC3=NC=NC4=C3C(=CC(=C4)OCCOC)F
    InChIKey
    FLJOFQUXYAWOPE-UHFFFAOYSA-N
    InChI
    1S/C24H26FN7O3/c1-15(2)21-12-32(31-30-21)13-22(33)28-16-4-6-17(7-5-16)29-24-23-19(25)10-18(35-9-8-34-3)11-20(23)26-14-27-24/h4-7,10-12,14-15H,8-9,13H2show more
    Synonyms
    AZD3229 | AZD-3229 | N-(4-((5-fluoro-7-(2-methoxyethoxy)quinazolin-4-yl)amino)phenyl)-2-(4-isopropyl-1H-1,2,3-triazol...
  12. AZD3229
    CAS: 2248003-60-1 Formula: C24H26FN7O3 Molecular Weight: 479.51
    ● In Stock — US warehouse, ships to EU* Item #: A414175
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    Technical Identifiers
    IUPAC Name
    N-[4-[[5-fluoro-7-(2-methoxyethoxy)quinazolin-4-yl]amino]phenyl]-2-(4-propan-2-yltriazol-1-yl)acetamide
    SMILES
    CC(C)C1=CN(N=N1)CC(=O)NC2=CC=C(C=C2)NC3=NC=NC4=C3C(=CC(=C4)OCCOC)F
    InChIKey
    FLJOFQUXYAWOPE-UHFFFAOYSA-N
    InChI
    1S/C24H26FN7O3/c1-15(2)21-12-32(31-30-21)13-22(33)28-16-4-6-17(7-5-16)29-24-23-19(25)10-18(35-9-8-34-3)11-20(23)26-14-27-24/h4-7,10-12,14-15H,8-9,13H2show more
    Synonyms
    AZD3229 | AZD-3229 | N-(4-((5-fluoro-7-(2-methoxyethoxy)quinazolin-4-yl)amino)phenyl)-2-(4-isopropyl-1H-1,2,3-triazol...
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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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