Targets & Pathways

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. PKG drug G1
    CAS: 374703-78-3 PubChem CID: 135402990 Formula: C13H11N3OS Molecular Weight: 257.31
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P423688
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    Technical Identifiers
    IUPAC Name
    4-hydroxy-5-[(Z)-(2-methylindol-3-ylidene)methyl]-1,3-dihydroimidazole-2-thione
    SMILES
    CC1=NC2=CC=CC=C2C1=CC3=C(NC(=S)N3)O
    InChIKey
    BPJCCABLAZZIEJ-RMKNXTFCSA-N
    InChI
    1S/C13H11N3OS/c1-7-9(6-11-12(17)16-13(18)15-11)8-4-2-3-5-10(8)14-7/h2-6,17H,1H3,(H2,15,16,18)/b9-6+
    Synonyms
    4-​Imidazolidinone,5-​[(2-​methyl-​1H-​indol-​3-​yl)​methylene]​-​2-​thioxo-
  2. PI-103, Inhibitor of mechanistic target of rapamycin kinase;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;
    CAS: 371935-74-9 Formula: C19H16N4O3 Molecular Weight: 348.36
    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 #: P408008
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    Synonyms
    Phenol, 3-[4-(4-morpholinyl)pyrido[3',2':4,5]furo[3,2-d]pyrimidin-2-yl]-
  3. PKC-theta inhibitor
    CAS: 736048-65-0 PubChem CID: 10253430 Formula: C2OH25F3N6O3 Molecular Weight: 454.45
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P425739
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    Technical Identifiers
    IUPAC Name
    4-N-[[4-(aminomethyl)cyclohexyl]methyl]-5-nitro-2-N-[[2-(trifluoromethoxy)phenyl]methyl]pyrimidine-2,4-diamine
    SMILES
    C1CC(CCC1CN)CNC2=NC(=NC=C2[N+](=O)[O-])NCC3=CC=CC=C3OC(F)(F)F
    InChIKey
    HKOWATVSFKRXRW-UHFFFAOYSA-N
    InChI
    1S/C20H25F3N6O3/c21-20(22,23)32-17-4-2-1-3-15(17)11-26-19-27-12-16(29(30)31)18(28-19)25-10-14-7-5-13(9-24)6-8-14/h1-4,12-14H,5-11,24H2,(H2,25,26,27,28show more
    Synonyms
    2,​4-​Pyrimidinediamine,N4-​[[4-​(aminomethyl)​cyclohexyl]​methyl]​-​5-​nitro-​N2-​[[2-​(trifluoromethoxy)​phenyl]​me...
  4. PKG drug G1
    CAS: 374703-78-3 PubChem CID: 135402990 Formula: C13H11N3OS Molecular Weight: 257.31
    ● In Stock — US warehouse, ships to EU* Item #: P412207
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    Technical Identifiers
    IUPAC Name
    4-hydroxy-5-[(Z)-(2-methylindol-3-ylidene)methyl]-1,3-dihydroimidazole-2-thione
    SMILES
    CC1=NC2=CC=CC=C2C1=CC3=C(NC(=S)N3)O
    InChIKey
    BPJCCABLAZZIEJ-RMKNXTFCSA-N
    InChI
    1S/C13H11N3OS/c1-7-9(6-11-12(17)16-13(18)15-11)8-4-2-3-5-10(8)14-7/h2-6,17H,1H3,(H2,15,16,18)/b9-6+
    Synonyms
    4-​Imidazolidinone,5-​[(2-​methyl-​1H-​indol-​3-​yl)​methylene]​-​2-​thioxo-
  5. PGB2 (Prostaglandin B2)
    CAS: 13367-85-6 EC Number: 635-050-8 PubChem CID: 5280881 Formula: C20H30O4 Molecular Weight: 334.46
    ≥98% 1mg/100uL in methyl acetate
    ● In Stock — US warehouse, ships to EU* Item #: P332691
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    IUPAC Name
    (Z)-7-[2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopenten-1-yl]hept-5-enoic acid
    SMILES
    CCCCCC(C=CC1=C(C(=O)CC1)CC=CCCCC(=O)O)O
    InChIKey
    PRFXRIUZNKLRHM-HKVRTXJWSA-N
    InChI
    1S/C20H30O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h4,7,12,14,17,21H,2-3,5-6,8-11,13,15H2,1H3,(H,23,24)/b7-4-,14-12+/t17-/show more
    Synonyms
    BCBcMAP01_000173 | BIU61O9T9T | DINOPROSTONE IMPURITY, (5Z,13E,15S)-15-HYDROXY-9-OXOPROSTA-5, 8(12),13-TRIEN-1-OIC AC...
  6. PH-002
    CAS: 1311174-68-1 PubChem CID: 71451956 Formula: C27H33N5O4 Molecular Weight: 491.58
    ● In Stock — US warehouse, ships to EU* Item #: P412166
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    IUPAC Name
    tert-butyl 4-[[4-[[2-(3-methyl-4-oxophthalazin-1-yl)acetyl]amino]phenyl]methyl]piperazine-1-carboxylate
    SMILES
    CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC=C(C=C2)NC(=O)CC3=NN(C(=O)C4=CC=CC=C43)C
    InChIKey
    GSXXTLWPQMHHDJ-UHFFFAOYSA-N
    InChI
    1S/C27H33N5O4/c1-27(2,3)36-26(35)32-15-13-31(14-16-32)18-19-9-11-20(12-10-19)28-24(33)17-23-21-7-5-6-8-22(21)25(34)30(4)29-23/h5-12H,13-18H2,1-4H3,(H,show more
    Synonyms
    tert-Butyl 4-(4-(2-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)acetamido)benzyl)piperazine-1-carboxylate
  7. PHA-665752, Inhibitor of MET proto-oncogene; receptor tyrosine kinase
    CAS: 477575-56-7 Formula: C32H34Cl2N4O4S Molecular Weight: 641.61
    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 #: P407767
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    Technical Identifiers
    Synonyms
    (R,Z)-5-(2,6-dichlorobenzylsulfonyl)-3-((3,5-dimethyl-4-(2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carbonyl)-1H-pyrrol-2...
  8. PI4KIIIbeta-IN-9
    CAS: 1429624-84-9 PubChem CID: 71533728 Formula: C23H25N3O5S2 Molecular Weight: 487.6
    ● In Stock — US warehouse, ships to EU* Item #: P412989
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    IUPAC Name
    N-[5-[3-[(4-hydroxyphenyl)sulfamoyl]-4-methoxyphenyl]-4-methyl-1,3-thiazol-2-yl]cyclopentanecarboxamide
    SMILES
    CC1=C(SC(=N1)NC(=O)C2CCCC2)C3=CC(=C(C=C3)OC)S(=O)(=O)NC4=CC=C(C=C4)O
    InChIKey
    KAXNDTMKFONXJM-UHFFFAOYSA-N
    InChI
    1S/C23H25N3O5S2/c1-14-21(32-23(24-14)25-22(28)15-5-3-4-6-15)16-7-12-19(31-2)20(13-16)33(29,30)26-17-8-10-18(27)11-9-17/h7-13,15,26-27H,3-6H2,1-2H3,(H,show more
  9. PIK-294
    CAS: 900185-02-6 EC Number: 110-148-9 Formula: C28H23N7O2 Molecular Weight: 489.53
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P409185
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    Synonyms
    2-((4-amino-3-(3-hydroxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)methyl)-5-methyl-3-o-tolylquinazolin-4(3H)-one
  10. PIK-75
    CAS: 372196-77-5 PubChem CID: 45265864 Formula: C16H14BrN5O4S·HCl Molecular Weight: 488.74
    2mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P423673
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    Technical Identifiers
    IUPAC Name
    N-[(E)-(6-bromoimidazo[1,2-a]pyridin-3-yl)methylideneamino]-N,2-dimethyl-5-nitrobenzenesulfonamide;hydrochloride
    SMILES
    CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N(C)N=CC2=CN=C3N2C=C(C=C3)Br.Cl
    InChIKey
    VOUDEIAYNKZQKM-MYHMWQFYSA-N
    InChI
    1S/C16H14BrN5O4S.ClH/c1-11-3-5-13(22(23)24)7-15(11)27(25,26)20(2)19-9-14-8-18-16-6-4-12(17)10-21(14)16;/h3-10H,1-2H3;1H/b19-9+;
    Synonyms
    (E)-N'-((6-bromoimidazo[1,2-a]pyridin-3-yl)methylene)-N,2-dimethyl-5-nitrobenzenesulfonohydrazide hydrochloride | (E)...
  11. PIK-93, Inhibitor of phosphatidylinositol 4-kinase beta
    CAS: 593960-11-3 Formula: C14H16ClN3O4S2 Molecular Weight: 389.88
    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 #: P408723
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    Technical Identifiers
    Synonyms
    N-[5-[4-Chloro-3-[(2-hydroxyethyl)sulfamoyl]phenyl]-4-methylthiazol-2-yl]acetamide
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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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