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. SS58Uxz8ZU
    CAS: 210751-39-6 Formula: C24H25FN4O2S Molecular Weight: 452.5
    ◐ Made to order · 8–12 wks Item #: S668871
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    Technical Identifiers
    IUPAC Name
    3-[2-[4-(6-fluoro-1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-2lambda6-thia-1,3-diazatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-triene 2,2-dioxide
    SMILES
    C1CC2=C3C(=CC=C2)N(S(=O)(=O)N3C1)CCN4CCC(=CC4)C5=CNC6=C5C=CC(=C6)F
    InChIKey
    BJIPVHLRWSDKOS-UHFFFAOYSA-N
    InChI
    1S/C24H25FN4O2S/c25-19-6-7-20-21(16-26-22(20)15-19)17-8-11-27(12-9-17)13-14-28-23-5-1-3-18-4-2-10-29(24(18)23)32(28,30)31/h1,3,5-8,15-16,26H,2,4,9-14Hshow more
    Synonyms
    LY-367,265|LY-367265|LY367265|LY 367265|1-(2-(4-(6-Fluoro-1H-indol-3-yl)-3,6-dihydro-1(2H)-pyridinyl)ethyl)-5,6-dihyd...
  2. Saripidem
    CAS: 103844-86-6 PubChem CID: 3058746 Formula: C19H20ClN3O Molecular Weight: 341.8
    ◐ Made to order · 8–12 wks Item #: S668800
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    IUPAC Name
    N-[[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]-N-methylbutanamide
    SMILES
    CCCC(=O)N(C)CC1=C(N=C2N1C=CC=C2)C3=CC=C(C=C3)Cl
    InChIKey
    LIFDPEORUVTOCP-UHFFFAOYSA-N
    InChI
    1S/C19H20ClN3O/c1-3-6-18(24)22(2)13-16-19(14-8-10-15(20)11-9-14)21-17-7-4-5-12-23(16)17/h4-5,7-12H,3,6,13H2,1-2H3
    Synonyms
    Saripidem|Saripidem [INN]|N-((2-(p-Chlorophenyl)-imidazo(1,2-a)pyridin-3-yl)methyl)-N-methylbutyramide.|Butanamide, N...
  3. S-Isopropyl-isothiourea
    CAS: 6913-17-3 PubChem CID: 445319 Formula: C4H10N2S Molecular Weight: 118.2
    ◐ Made to order · 8–12 wks Item #: S668288
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    IUPAC Name
    propan-2-yl carbamimidothioate
    SMILES
    CC(C)SC(=N)N
    InChIKey
    XSSNABKEYXKKMK-UHFFFAOYSA-N
    InChI
    1S/C4H10N2S/c1-3(2)7-4(5)6/h3H,1-2H3,(H3,5,6)
    Synonyms
    S-ISOPROPYL-ISOTHIOUREA|2-Isopropyl-isothiourea|Isopropyl carbamimidothioate|propan-2-yl carbamimidothioate|S-isoprop...
  4. SR-59230A free base
    CAS: 174689-38-4 Formula: C21H27NO2 Molecular Weight: 325.4
    ◐ Made to order · 8–12 wks Item #: S668915
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    Technical Identifiers
    IUPAC Name
    (2S)-1-(2-ethylphenoxy)-3-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]propan-2-ol
    SMILES
    CCC1=CC=CC=C1OCC(CNC2CCCC3=CC=CC=C23)O
    InChIKey
    VFDHMSXXELYMRW-ICSRJNTNSA-N
    InChI
    1S/C21H27NO2/c1-2-16-8-4-6-13-21(16)24-15-18(23)14-22-20-12-7-10-17-9-3-5-11-19(17)20/h3-6,8-9,11,13,18,20,22-23H,2,7,10,12,14-15H2,1H3/t18-,20-/m0/s1
    Synonyms
    SR-59230A free base|SR 59230A - parent|SR-59230A|SR-59230A free base, (-)-|(S)-1-(2-ETHYLPHENOXY)-3-(((S)-1,2,3,4-TET...
  5. SSR-504734 free base
    CAS: 742693-38-5 PubChem CID: 9954540 Formula: C20H20ClF3N2O Molecular Weight: 396.8
    ◐ Made to order · 8–12 wks Item #: S669051
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    IUPAC Name
    2-chloro-N-[(S)-phenyl-[(2S)-piperidin-2-yl]methyl]-3-(trifluoromethyl)benzamide
    SMILES
    C1CCNC(C1)C(C2=CC=CC=C2)NC(=O)C3=C(C(=CC=C3)C(F)(F)F)Cl
    InChIKey
    MEZRZVWPLXVLSO-WMZOPIPTSA-N
    InChI
    1S/C20H20ClF3N2O/c21-17-14(9-6-10-15(17)20(22,23)24)19(27)26-18(13-7-2-1-3-8-13)16-11-4-5-12-25-16/h1-3,6-10,16,18,25H,4-5,11-12H2,(H,26,27)/t16-,18-/show more
    Synonyms
    SSR-504734 free base|2-Chloro-N-((S)-phenyl((2S)-piperidin-2-yl)methyl)-3-(trifluoromethyl)benzamide|Benzamide, 2-chl...
  6. Scandenin
    CAS: 5084-00-4 Formula: C26H26O6 Molecular Weight: 434.5
    ◐ Made to order · 8–12 wks Item #: S669266
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    IUPAC Name
    4-hydroxy-3-(4-hydroxyphenyl)-5-methoxy-8,8-dimethyl-6-(3-methylbut-2-enyl)pyrano[2,3-h]chromen-2-one
    SMILES
    CC(=CCC1=C2C(=C3C(=C1OC)C(=C(C(=O)O3)C4=CC=C(C=C4)O)O)C=CC(O2)(C)C)C
    InChIKey
    AAKJUGSASOCUFQ-UHFFFAOYSA-N
    InChI
    1S/C26H26O6/c1-14(2)6-11-17-22-18(12-13-26(3,4)32-22)24-20(23(17)30-5)21(28)19(25(29)31-24)15-7-9-16(27)10-8-15/h6-10,12-13,27-28H,11H2,1-5H3
    Synonyms
    Scandenin|SDCCGMLS-0066849.P001|2H,8H-Benzo[1,2-b:3,4-b']dipyran-2-one, 4-hydroxy-3-(4-hydroxyphenyl)-5-methoxy-8,8-d...
  7. Sunepitron
    CAS: 131831-03-3 PubChem CID: 183092 Formula: C17H23N5O2 Molecular Weight: 329.4
    ◐ Made to order · 8–12 wks Item #: S668123
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    IUPAC Name
    1-[[(7S,9aS)-2-pyrimidin-2-yl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-7-yl]methyl]pyrrolidine-2,5-dione
    SMILES
    C1CC2CN(CCN2CC1CN3C(=O)CCC3=O)C4=NC=CC=N4
    InChIKey
    UXWBIYCPUVWKHP-KBPBESRZSA-N
    InChI
    1S/C17H23N5O2/c23-15-4-5-16(24)22(15)11-13-2-3-14-12-21(9-8-20(14)10-13)17-18-6-1-7-19-17/h1,6-7,13-14H,2-5,8-12H2/t13-,14-/m0/s1
    Synonyms
    sunepitron|Sunepitron [INN]|Cp 93393|CP-93393|CP-93,393|2,5-Pyrrolidinedione, 1-(((7S,9aS)-octahydro-2-(2-pyrimidinyl...
  8. Terikalant
    CAS: 132338-79-5 Formula: C24H31NO3 Molecular Weight: 381.5
    ◐ Made to order · 8–12 wks Item #: T667936
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    Technical Identifiers
    IUPAC Name
    1-[2-[(4S)-3,4-dihydro-2H-chromen-4-yl]ethyl]-4-(3,4-dimethoxyphenyl)piperidine
    SMILES
    COC1=C(C=C(C=C1)C2CCN(CC2)CCC3CCOC4=CC=CC=C34)OC
    InChIKey
    UIZPEXQHMIZQPQ-IBGZPJMESA-N
    InChI
    1S/C24H31NO3/c1-26-23-8-7-20(17-24(23)27-2)18-9-13-25(14-10-18)15-11-19-12-16-28-22-6-4-3-5-21(19)22/h3-8,17-19H,9-16H2,1-2H3/t19-/m0/s1
    Synonyms
    Terikalant|Terikalant [INN]|RP-58866|1-[2-[(4S)-3,4-dihydro-2H-chromen-4-yl]ethyl]-4-(3,4-dimethoxyphenyl)piperidine|...
  9. Spiro[9h-fluorene-9,4'-imidazolidine]-2',5'-dione
    CAS: 6278-92-8 EC Number: 879-073-3 PubChem CID: 234512 Formula: C15H10N2O2 Molecular Weight: 250.25
    ◐ Made to order · 8–12 wks Item #: S668176
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    Technical Identifiers
    IUPAC Name
    spiro[fluorene-9,5'-imidazolidine]-2',4'-dione
    SMILES
    C1=CC=C2C(=C1)C3=CC=CC=C3C24C(=O)NC(=O)N4
    InChIKey
    SCDXMQOKVWBFBD-UHFFFAOYSA-N
    InChI
    1S/C15H10N2O2/c18-13-15(17-14(19)16-13)11-7-3-1-5-9(11)10-6-2-4-8-12(10)15/h1-8H,(H2,16,17,18,19)
    Synonyms
    spiro[9h-fluorene-9,4'-imidazolidine]-2',5'-dione|SPIRO[FLUORENE-9,4'-IMIDAZOLIDINE]-2',5'-DIONE|spiro(fluorene-9,4'-...
  10. Sezolamide
    CAS: 123308-22-5 Formula: C11H18N2O4S3 Molecular Weight: 338.5
    ◐ Made to order · 8–12 wks Item #: S667921
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    IUPAC Name
    (4S)-4-(2-methylpropylamino)-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide
    SMILES
    CC(C)CNC1CCS(=O)(=O)C2=C1C=C(S2)S(=O)(=O)N
    InChIKey
    JFLUCCKXAYBETQ-VIFPVBQESA-N
    InChI
    1S/C11H18N2O4S3/c1-7(2)6-13-9-3-4-19(14,15)11-8(9)5-10(18-11)20(12,16)17/h5,7,9,13H,3-4,6H2,1-2H3,(H2,12,16,17)/t9-/m0/s1
    Synonyms
    SEZOLAMIDE|Sezolamide [INN]|(4S)-4-(2-methylpropylamino)-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamid...
  11. Tebufelone
    CAS: 112018-00-5 Formula: C20H28O2 Molecular Weight: 300.44
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥97%
    ● In Stock — US warehouse, ships to EU* Item #: T667919
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    IUPAC Name
    1-(3,5-ditert-butyl-4-hydroxyphenyl)hex-5-yn-1-one
    SMILES
    CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CCCC#C
    InChIKey
    ZHXUEUKVDMWSKV-UHFFFAOYSA-N
    InChI
    1S/C20H28O2/c1-8-9-10-11-17(21)14-12-15(19(2,3)4)18(22)16(13-14)20(5,6)7/h1,12-13,22H,9-11H2,2-7H3
    Synonyms
    Tebufelone|1-(3,5-ditert-butyl-4-hydroxyphenyl)hex-5-yn-1-one|NE 11740|3',5'-Di-tert-butyl-4'-hydroxy-5-hexynophenone...
  12. Tanogitran
    CAS: 637328-69-9 Formula: C25H31N7O3 Molecular Weight: 477.6
    ◐ Made to order · 8–12 wks Item #: T669016
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    IUPAC Name
    2-[[(2R)-2-[2-[(4-carbamimidoylanilino)methyl]-1-methylbenzimidazol-5-yl]-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]amino]acetic acid
    SMILES
    CC(C1=CC2=C(C=C1)N(C(=N2)CNC3=CC=C(C=C3)C(=N)N)C)(C(=O)N4CCCC4)NCC(=O)O
    InChIKey
    MAOALPSHCIBFJZ-RUZDIDTESA-N
    InChI
    1S/C25H31N7O3/c1-25(29-15-22(33)34,24(35)32-11-3-4-12-32)17-7-10-20-19(13-17)30-21(31(20)2)14-28-18-8-5-16(6-9-18)23(26)27/h5-10,13,28-29H,3-4,11-12,1show more
    Synonyms
    Tanogitran|Tanogitran [INN]|BIBT986|BIBT-986|N-((2R)-2-(2-((4-Carbamimidoylanilino)methyl)-1-methyl-1H-benzimidazol-5...
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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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