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).

136,943 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

2,815

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. Ranolazine-d8dihydrochloride
    CAS: 1219802-60-4 PubChem CID: 49849870 Formula: C24H27D8Cl2N3O4 Molecular Weight: 508.51
    ◐ Made to order · 8–12 wks Item #: R651606
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    IUPAC Name
    N-(2,6-dimethylphenyl)-2-[2,2,3,3,5,5,6,6-octadeuterio-4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-yl]acetamide;dihydrochloride
    SMILES
    CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC(COC3=CC=CC=C3OC)O.Cl.Cl
    InChIKey
    RJNSNFZXAZXOFX-ZWKVGDSCSA-N
    InChI
    1S/C24H33N3O4.2ClH/c1-18-7-6-8-19(2)24(18)25-23(29)16-27-13-11-26(12-14-27)15-20(28)17-31-22-10-5-4-9-21(22)30-3;;/h4-10,20,28H,11-17H2,1-3H3,(H,25,29show more
    Synonyms
    N-(2,6-dimethylphenyl)-2-[2,2,3,3,5,5,6,6-octadeuterio-4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-yl]acetami...
  2. EHT 1610
    CAS: 1425945-60-3 Formula: C18H14FN5O2S Molecular Weight: 383.40
    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%
    ◐ Made to order · 8–12 wks Item #: E651619
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    IUPAC Name
    methyl 9-(2-fluoro-4-methoxyanilino)-[1,3]thiazolo[5,4-f]quinazoline-2-carboximidate
    SMILES
    COC1=CC(=C(C=C1)NC2=NC=NC3=C2C4=C(C=C3)N=C(S4)C(=N)OC)F
    InChIKey
    RYBNARZBIXTFJS-UHFFFAOYSA-N
    InChI
    1S/C18H14FN5O2S/c1-25-9-3-4-11(10(19)7-9)23-17-14-12(21-8-22-17)5-6-13-15(14)27-18(24-13)16(20)26-2/h3-8,20H,1-2H3,(H,21,22,23)
  3. Bersacapavir, Core antigen modulator
    CAS: 1638266-40-6 PubChem CID: 121294984 Formula: C16H14F4N4O3S Molecular Weight: 418.37
    Solid ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: B651624
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    IUPAC Name
    N-(3-cyano-4-fluorophenyl)-1-methyl-4-[[(2S)-1,1,1-trifluoropropan-2-yl]sulfamoyl]pyrrole-2-carboxamide
    SMILES
    C[C@@H](C(F)(F)F)NS(=O)(=O)C1=CN(C(=C1)C(=O)NC2=CC(=C(C=C2)F)C#N)C
    InChIKey
    SBVBIDUKSBJYEF-VIFPVBQESA-N
    InChI
    1S/C16H14F4N4O3S/c1-9(16(18,19)20)23-28(26,27)12-6-14(24(2)8-12)15(25)22-11-3-4-13(17)10(5-11)7-21/h3-6,8-9,23H,1-2H3,(H,22,25)/t9-/m0/s1
    Synonyms
    Bersacapavir|BERSACAPAVIR [WHO-DD]|Bersacapavir [USAN:INN]|Bersacapavir [USAN]|N-(3-Cyano-4-fluorophenyl)-1-methyl-4-...
  4. XZ739
    CAS: 2365172-19-4 PubChem CID: 139331521 Formula: C65H76ClF3N8O12S3 Molecular Weight: 1349.99
    ◐ Made to order · 8–12 wks Item #: X651545
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    IUPAC Name
    4-[4-[[2-(4-chlorophenyl)-5,5-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-N-[4-[[(2R)-4-[2-[2-[2-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolshow more
    SMILES
    CC1(CCC(=C(C1)CN2CCN(CC2)C3=CC=C(C=C3)C(=O)NS(=O)(=O)C4=CC(=C(C=C4)NC(CCN(C)CCOCCOCCOCCNC5=CC=CC6=C5C(=O)N(C6=O)C7CCC(=O)NC7=O)CSC8=CC=CC=C8)S(=O)(=O)show more
    InChIKey
    RTASGZOITGGVPZ-YJUSKGKKSA-N
    InChI
    1S/C65H76ClF3N8O12S3/c1-64(2)26-24-52(44-12-16-47(66)17-13-44)46(41-64)42-75-29-31-76(32-30-75)49-18-14-45(15-19-49)60(79)73-92(85,86)51-20-21-54(57(4show more
  5. T807
    CAS: 1415379-56-4 EC Number: 807-515-7 PubChem CID: 71059746 Formula: C16H10FN3 Molecular Weight: 263.27
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥99%
    ● In Stock — US warehouse, ships to EU* Item #: T651547
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    IUPAC Name
    7-(6-fluoropyridin-3-yl)-5H-pyrido[4,3-b]indole
    SMILES
    C1=CC2=C(C=C1C3=CN=C(C=C3)F)NC4=C2C=NC=C4
    InChIKey
    GETAAWDSFUCLBS-UHFFFAOYSA-N
    InChI
    1S/C16H10FN3/c17-16-4-2-11(8-19-16)10-1-3-12-13-9-18-6-5-14(13)20-15(12)7-10/h1-9,20H
    Synonyms
    Flortaucipir (F-18)|7-(6-fluoropyridin-3-yl)-5h-pyrido[4,3-b]indole|7-(6-Fluoro-3-pyridinyl)-5H-pyrido[4,3-b]indole|5...
  6. Benzylthiouracil
    CAS: 6336-50-1 PubChem CID: 685814 Formula: C11H10N2OS Molecular Weight: 218.28
    ● In Stock — US warehouse, ships to EU* Item #: B651553
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    IUPAC Name
    6-benzyl-2-sulfanylidene-1H-pyrimidin-4-one
    SMILES
    C1=CC=C(C=C1)CC2=CC(=O)NC(=S)N2
    InChIKey
    PNXBXCRWXNESOV-UHFFFAOYSA-N
    InChI
    1S/C11H10N2OS/c14-10-7-9(12-11(15)13-10)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,12,13,14,15)
    Synonyms
    Benzylthiouracil|6-Benzyl-2-thiouracil|Basdene|bentiuracil|6-benzyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one|6-benzyl-...
  7. Beta-D-Glucopyranosyl nitromethane
    CAS: 81846-60-8 PubChem CID: 22865379 Formula: C7H13NO7 Molecular Weight: 223.18
    ◐ Made to order · 8–12 wks Item #: B651552
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    IUPAC Name
    (2R,3S,4R,5R,6S)-2-(hydroxymethyl)-6-(nitromethyl)oxane-3,4,5-triol
    SMILES
    C(C1C(C(C(C(O1)CO)O)O)O)[N+](=O)[O-]
    InChIKey
    CNILFIXWGGSLAQ-PJEQPVAWSA-N
    InChI
    1S/C7H13NO7/c9-2-4-6(11)7(12)5(10)3(15-4)1-8(13)14/h3-7,9-12H,1-2H2/t3-,4+,5-,6+,7+/m0/s1
    Synonyms
    beta-D-Glucopyranosylnitromethane|(2R,3S,4R,5R,6S)-2-(Hydroxymethyl)-6-(nitromethyl)tetrahydro-2H-pyran-3,4,5-triol|(...
  8. Tiafenacil
    CAS: 1220411-29-9 PubChem CID: 67295585 Formula: C19H18ClF4N3O5S Molecular Weight: 511.87
    ◐ Made to order · 8–12 wks Item #: T651554
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    Technical Identifiers
    SMILES
    CC(C(=O)NCCC(=O)OC)SC1=C(C=C(C(=C1)N2C(=O)C=C(N(C2=O)C)C(F)(F)F)F)Cl
  9. Iperoxo
    CAS: 247079-84-1 EC Number: 803-428-3 PubChem CID: 46855274 Formula: C9H14N2O2 Molecular Weight: 182.22
    ◐ Made to order · 8–12 wks Item #: I651708
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    Technical Identifiers
    IUPAC Name
    4-(4,5-dihydro-1,2-oxazol-3-yloxy)-N,N-dimethylbut-2-yn-1-amine
    SMILES
    CN(C)CC#CCOC1=NOCC1
    InChIKey
    CADHNBBPGYVTOA-UHFFFAOYSA-N
    InChI
    1S/C9H14N2O2/c1-11(2)6-3-4-7-12-9-5-8-13-10-9/h5-8H2,1-2H3
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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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