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. PFK15, Inhibitor of 6-phosphofructo-2-kinase/fructose-2;6-biphosphatase 3
    CAS: 4382-63-2 EC Number: 809-326-5 PubChem CID: 25142799 Formula: C17H12N2O Molecular Weight: 260.29
    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 #: P407887
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    Synonyms
    PFK-015 | 2-​Propen-​1-​one, 1-​(4-​pyridinyl)​-​3-​(2-​quinolinyl)​-
  2. PFK158
    CAS: 1462249-75-7 PubChem CID: 71730058 Formula: C18H11F3N2O Molecular Weight: 328.29
    ● In Stock — US warehouse, ships to EU* Item #: P414193
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    Technical Identifiers
    IUPAC Name
    (E)-1-pyridin-4-yl-3-[7-(trifluoromethyl)quinolin-2-yl]prop-2-en-1-one
    SMILES
    C1=CC(=CC2=C1C=CC(=N2)C=CC(=O)C3=CC=NC=C3)C(F)(F)F
    InChIKey
    IAJOMYABKVAZCN-AATRIKPKSA-N
    InChI
    1S/C18H11F3N2O/c19-18(20,21)14-3-1-12-2-4-15(23-16(12)11-14)5-6-17(24)13-7-9-22-10-8-13/h1-11H/b6-5+
    Synonyms
    2HOK1JQ203 | HY-12203 | N17011 | (E)-1-(pyridin-4-yl)-3-(7-(trifluoromethyl)quinolin-2-yl)prop-2-en-1-one | AC-35725 ...
  3. PFK158
    CAS: 1462249-75-7 PubChem CID: 71730058 Formula: C18H11F3N2O Molecular Weight: 328.29
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P421690
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    Technical Identifiers
    IUPAC Name
    (E)-1-pyridin-4-yl-3-[7-(trifluoromethyl)quinolin-2-yl]prop-2-en-1-one
    SMILES
    C1=CC(=CC2=C1C=CC(=N2)C=CC(=O)C3=CC=NC=C3)C(F)(F)F
    InChIKey
    IAJOMYABKVAZCN-AATRIKPKSA-N
    InChI
    1S/C18H11F3N2O/c19-18(20,21)14-3-1-12-2-4-15(23-16(12)11-14)5-6-17(24)13-7-9-22-10-8-13/h1-11H/b6-5+
    Synonyms
    2HOK1JQ203 | HY-12203 | N17011 | (E)-1-(pyridin-4-yl)-3-(7-(trifluoromethyl)quinolin-2-yl)prop-2-en-1-one | AC-35725 ...
  4. PFM 01
    CAS: 1558598-41-6 PubChem CID: 2145809 Formula: C14H15NO2S2 Molecular Weight: 293.4
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P421860
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    IUPAC Name
    (5Z)-5-[(4-hydroxyphenyl)methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one
    SMILES
    CC(C)CN1C(=O)C(=CC2=CC=C(C=C2)O)SC1=S
    InChIKey
    GPURHDUTZUYAFI-GHXNOFRVSA-N
    InChI
    1S/C14H15NO2S2/c1-9(2)8-15-13(17)12(19-14(15)18)7-10-3-5-11(16)6-4-10/h3-7,9,16H,8H2,1-2H3/b12-7-
    Synonyms
    (5Z)-5-[(4-Hydroxyphenyl)methylene]-3-(2-methylpropyl)-2-thioxo-4-thiazolidinone;PFM01
  5. PH-064
    CAS: 892546-37-1 PubChem CID: 11593027 Formula: C44H58N8O2S2 Molecular Weight: 795.12
    ● In Stock — US warehouse, ships to EU* Item #: P412952
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    IUPAC Name
    (2R)-2-amino-3-[[(2R)-2-amino-3-[(8S)-8-(cyclohexylmethyl)-2-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-3-oxopropyl]disulfanyl]-1-[(8S)-8-(cyclshow more
    SMILES
    C1CCC(CC1)CC2C3=NC(=CN3CCN2C(=O)C(CSSCC(C(=O)N4CCN5C=C(N=C5C4CC6CCCCC6)C7=CC=CC=C7)N)N)C8=CC=CC=C8
    InChIKey
    GGDNOAWICIHSAW-KEAHXZLPSA-N
    InChI
    1S/C44H58N8O2S2/c45-35(43(53)51-23-21-49-27-37(33-17-9-3-10-18-33)47-41(49)39(51)25-31-13-5-1-6-14-31)29-55-56-30-36(46)44(54)52-24-22-50-28-38(34-19-show more
    Synonyms
    BIM-46187
  6. PH-797804, MAP kinase p38 alpha inhibitor
    CAS: 586379-66-0 EC Number: 110-020-2 Formula: C22H19BrF2N2O3 Molecular Weight: 477.3
    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 #: P408962
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    Synonyms
    3-(4-(2,4-difluorobenzyloxy)-3-bromo-6-methyl-2-oxopyridin-1(2H)-yl)-N,4-dimethylbenzamide
  7. PHA-793887, Cyclin-dependent kinase inhibitor
    CAS: 718630-59-2 Formula: C19H31N5O2 Molecular Weight: 361.48
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P407796
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    Synonyms
    N-(6,6-dimethyl-5-(1-methylpiperidine-4-carbonyl)-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazol-3-yl)-3-methylbutanamide
  8. PI 1840
    CAS: 1401223-22-0 PubChem CID: 56945245 Formula: C22H26N4O3 Molecular Weight: 394.47
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P421498
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    Technical Identifiers
    IUPAC Name
    N-propan-2-yl-2-(4-propylphenoxy)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide
    SMILES
    CCCC1=CC=C(C=C1)OCC(=O)N(CC2=NC(=NO2)C3=CN=CC=C3)C(C)C
    InChIKey
    ZVVXAODXPVWGMF-UHFFFAOYSA-N
    InChI
    1S/C22H26N4O3/c1-4-6-17-8-10-19(11-9-17)28-15-21(27)26(16(2)3)14-20-24-22(25-29-20)18-7-5-12-23-13-18/h5,7-13,16H,4,6,14-15H2,1-3H3
    Synonyms
    N-(1-Methylethyl)-2-(4-propylphenoxy)-N-[[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]methyl]-acetamide
  9. PHY34
    CAS: 2130033-55-3 PubChem CID: 134817266 Formula: C30H30O12 Molecular Weight: 582.55
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P422577
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    IUPAC Name
    4-[[(3aR,4S,6R,7S,7aS)-7-hydroxy-4-(hydroxymethyl)-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-9-(1,3-benzodioxol-5-yl)-3Hshow more
    SMILES
    CC1(OC2C(OC(C(C2O1)O)OC3=C4COC(=O)C4=C(C5=CC=CC=C53)C6=CC7=C(C=C6)OCO7)CO)C
    InChIKey
    FQJXRFGTBCRYIR-CLDHGOPBSA-N
    InChI
    1S/C28H26O10/c1-28(2)37-24-19(10-29)35-27(22(30)25(24)38-28)36-23-15-6-4-3-5-14(15)20(21-16(23)11-32-26(21)31)13-7-8-17-18(9-13)34-12-33-17/h3-9,19,22show more
  10. PI 1840
    CAS: 1401223-22-0 PubChem CID: 56945245 Formula: C22H26N4O3 Molecular Weight: 394.47
    ● In Stock — US warehouse, ships to EU* Item #: P342335
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    Technical Identifiers
    IUPAC Name
    N-propan-2-yl-2-(4-propylphenoxy)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide
    SMILES
    CCCC1=CC=C(C=C1)OCC(=O)N(CC2=NC(=NO2)C3=CN=CC=C3)C(C)C
    InChIKey
    ZVVXAODXPVWGMF-UHFFFAOYSA-N
    InChI
    1S/C22H26N4O3/c1-4-6-17-8-10-19(11-9-17)28-15-21(27)26(16(2)3)14-20-24-22(25-29-20)18-7-5-12-23-13-18/h5,7-13,16H,4,6,14-15H2,1-3H3
    Synonyms
    N-(1-Methylethyl)-2-(4-propylphenoxy)-N-[[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]methyl]-acetamide
  11. PLX-4720, Inhibitor of B-Raf proto-oncogene; serine/threonine kinase;Inhibitor of kinase insert domain receptor
    CAS: 918505-84-7 EC Number: 894-417-2 Formula: C17H14ClF2N3O3S Molecular Weight: 413.83
    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 #: P408219
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    Technical Identifiers
    Synonyms
    N-(3-(5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbonyl)-2,4-difluorophenyl)propane-1-sulfonamide
  12. PLX51107
    CAS: 1627929-55-8 PubChem CID: 90448953 Formula: C26H22N4O3 Molecular Weight: 438.48
    ● In Stock — US warehouse, ships to EU* Item #: P414147
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    Technical Identifiers
    IUPAC Name
    4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[(1S)-1-pyridin-2-ylethyl]pyrrolo[3,2-b]pyridin-3-yl]benzoic acid
    SMILES
    CC1=C(C(=NO1)C)C2=CC3=C(C(=CN3C(C)C4=CC=CC=N4)C5=CC=C(C=C5)C(=O)O)N=C2
    InChIKey
    AMSUHYUVOVCWTP-INIZCTEOSA-N
    InChI
    1S/C26H22N4O3/c1-15-24(17(3)33-29-15)20-12-23-25(28-13-20)21(18-7-9-19(10-8-18)26(31)32)14-30(23)16(2)22-6-4-5-11-27-22/h4-14,16H,1-3H3,(H,31,32)/t16-show more
    Synonyms
    HY-111422 | PLX 51107 [WHO-DD] | NSC806595 | NSC-806595 | A930121 | W758F1L9ND | EX-A1824 | BRD4 inhibitor PLX51107 |...
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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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