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. SB 200646
    CAS: 143797-63-1 PubChem CID: 126769 Formula: C15H14N4O Molecular Weight: 266.3
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: S421611
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    Technical Identifiers
    IUPAC Name
    1-(1-methylindol-5-yl)-3-pyridin-3-ylurea
    SMILES
    CN1C=CC2=C1C=CC(=C2)NC(=O)NC3=CN=CC=C3
    InChIKey
    OJZZJTLBYXHUSJ-UHFFFAOYSA-N
    InChI
    1S/C15H14N4O/c1-19-8-6-11-9-12(4-5-14(11)19)17-15(20)18-13-3-2-7-16-10-13/h2-10H,1H3,(H2,17,18,20)
    Synonyms
    HY-103129A | 1-(1-methylindol-5-yl)-3-(3-pyridyl)urea | UNII-RT8F72CL8L | N-(1-Methyl-1H-indol-5-yl)-N'-3-pyridinylur...
  2. S107
    CAS: 927871-76-9 EC Number: 806-275-0 PubChem CID: 24763624 Formula: C11H15NOS Molecular Weight: 209.31
    ● In Stock — US warehouse, ships to EU* Item #: S413592
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    IUPAC Name
    7-methoxy-4-methyl-3,5-dihydro-2H-1,4-benzothiazepine
    SMILES
    CN1CCSC2=C(C1)C=C(C=C2)OC
    InChIKey
    BGVCEGVSQDOGSB-UHFFFAOYSA-N
    InChI
    1S/C11H15NOS/c1-12-5-6-14-11-4-3-10(13-2)7-9(11)8-12/h3-4,7H,5-6,8H2,1-2H3
    Synonyms
    A12716 | 7-methoxy-4-methyl-3,5-dihydro-2H-1,4-benzothiazepine | EX-A2503 | S-107;S 107 | 7-Methoxy-4-methyl-2,3,4,5-...
  3. S107 hydrochloride
    CAS: 1357476-46-0 PubChem CID: 53311704 Formula: C11H16ClNOS Molecular Weight: 245.77
    ● In Stock — US warehouse, ships to EU* Item #: S412501
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    IUPAC Name
    7-methoxy-4-methyl-3,5-dihydro-2H-1,4-benzothiazepine;hydrochloride
    SMILES
    CN1CCSC2=C(C1)C=C(C=C2)OC.Cl
    InChIKey
    PKLKSAHANRLKJK-UHFFFAOYSA-N
    InChI
    1S/C11H15NOS.ClH/c1-12-5-6-14-11-4-3-10(13-2)7-9(11)8-12;/h3-4,7H,5-6,8H2,1-2H3;1H
    Synonyms
    1,​4-​Benzothiazepine,2,​3,​4,​5-​tetrahydro-​7-​methoxy-​4-​methyl-​,hydrochloride (1:1)
  4. S107 hydrochloride
    CAS: 1357476-46-0 PubChem CID: 53311704 Formula: C11H16ClNOS Molecular Weight: 245.77
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: S421360
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    Technical Identifiers
    IUPAC Name
    7-methoxy-4-methyl-3,5-dihydro-2H-1,4-benzothiazepine;hydrochloride
    SMILES
    CN1CCSC2=C(C1)C=C(C=C2)OC.Cl
    InChIKey
    PKLKSAHANRLKJK-UHFFFAOYSA-N
    InChI
    1S/C11H15NOS.ClH/c1-12-5-6-14-11-4-3-10(13-2)7-9(11)8-12;/h3-4,7H,5-6,8H2,1-2H3;1H
    Synonyms
    1,​4-​Benzothiazepine,2,​3,​4,​5-​tetrahydro-​7-​methoxy-​4-​methyl-​,hydrochloride (1:1)
  5. SAR125844
    CAS: 1116743-46-4 PubChem CID: 25182860 Formula: C25H23FN8O2S2 Molecular Weight: 550.63
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: S420628
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    IUPAC Name
    1-[6-[[6-(4-fluorophenyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl]-1,3-benzothiazol-2-yl]-3-(2-morpholin-4-ylethyl)urea
    SMILES
    C1COCCN1CCNC(=O)NC2=NC3=C(S2)C=C(C=C3)SC4=NN=C5N4N=C(C=C5)C6=CC=C(C=C6)F
    InChIKey
    ODIUNTQOXRXOIV-UHFFFAOYSA-N
    InChI
    1S/C25H23FN8O2S2/c26-17-3-1-16(2-4-17)19-7-8-22-30-31-25(34(22)32-19)37-18-5-6-20-21(15-18)38-24(28-20)29-23(35)27-9-10-33-11-13-36-14-12-33/h1-8,15H,show more
    Synonyms
    DTXSID901031348 | 1116743-46-4 | CALCIUM ACETATE, ANHYDROUS (EP IMPURITY) | SAR125844 | SAR-125844 | 1-(6-{[6-(4-fluo...
  6. SAR131675
    CAS: 1433953-83-3 PubChem CID: 71295845 Formula: C18H22N4O4 Molecular Weight: 358.39
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: S409096
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    Technical Identifiers
    Synonyms
    (R)-2-amino-1-ethyl-7-(3-hydroxy-4-methoxy-3-methylbut-1-ynyl)-N-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxa...
  7. SAR405, Inhibitor of phosphatidylinositol 3-kinase catalytic subunit type 3
    CAS: 1523406-39-4 Formula: C19H21ClF3N5O2 Molecular Weight: 443.85
    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
    ◐ .Made to order · 8–12 wks Item #: S408270
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    Technical Identifiers
    Synonyms
    4H-​Pyrimido[1,​2-​a]​pyrimidin-​4-​one, 9-​[(5-​chloro-​3-​pyridinyl)​methyl]​-​6,​7,​8,​9-​tetrahydro-​2-​[(3R)​-​3-�...
  8. SAR405 R enantiomer
    CAS: 1946010-79-2 PubChem CID: 91933781 Formula: C19H21ClF3N5O2 Molecular Weight: 443.8
    ◐ .Made to order · 8–12 wks Item #: S413124
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    Technical Identifiers
    IUPAC Name
    (8R)-9-[(5-chloropyridin-3-yl)methyl]-2-[(3R)-3-methylmorpholin-4-yl]-8-(trifluoromethyl)-7,8-dihydro-6H-pyrimido[1,2-a]pyrimidin-4-one
    SMILES
    CC1COCCN1C2=CC(=O)N3CCC(N(C3=N2)CC4=CC(=CN=C4)Cl)C(F)(F)F
    InChIKey
    SPDQRCUBFSRAFI-IUODEOHRSA-N
    InChI
    1S/C19H21ClF3N5O2/c1-12-11-30-5-4-26(12)16-7-17(29)27-3-2-15(19(21,22)23)28(18(27)25-16)10-13-6-14(20)9-24-8-13/h6-9,12,15H,2-5,10-11H2,1H3/t12-,15-/mshow more
  9. SB 271046 hydrochloride
    CAS: 209481-24-3 Formula: C20H22CIN3O3S2.HCl Molecular Weight: 488.45
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: S408477
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    Synonyms
    5-Chloro-N-(4-methoxy-3-piperazin-1-yl-phenyl)-3-methyl-2-benzo-thiophenesulfonamide hydrochloride
  10. SB 277011-A Hydrochloride
    CAS: 215804-67-4 PubChem CID: 24845776 Formula: C28H30N4O・HCl Molecular Weight: 475.02
    ◐ .Made to order · 8–12 wks Item #: S335491
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    Technical Identifiers
    IUPAC Name
    N-[4-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]quinoline-4-carboxamide;hydrochloride
    SMILES
    C1CC(CCC1CCN2CCC3=C(C2)C=CC(=C3)C#N)NC(=O)C4=CC=NC5=CC=CC=C45.Cl
    InChIKey
    DKPTUMKZXQOJCX-UHFFFAOYSA-N
    InChI
    1S/C28H30N4O.ClH/c29-18-21-5-8-23-19-32(16-13-22(23)17-21)15-12-20-6-9-24(10-7-20)31-28(33)26-11-14-30-27-4-2-1-3-25(26)27;/h1-5,8,11,14,17,20,24H,6-7show more
    Synonyms
    N-[4-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]quinoline-4-carboxamide | hydrochloride
  11. SB 290157 trifluoroacetate
    CAS: 1140525-25-2 PubChem CID: 16760645 Formula: C24H29F3N4O6 Molecular Weight: 526.51
    ● In Stock — US warehouse, ships to EU* Item #: S287899
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    Technical Identifiers
    IUPAC Name
    (2S)-5-(diaminomethylideneamino)-2-[[2-(2,2-diphenylethoxy)acetyl]amino]pentanoic acid;2,2,2-trifluoroacetic acid
    SMILES
    C1=CC=C(C=C1)C(COCC(=O)NC(CCCN=C(N)N)C(=O)O)C2=CC=CC=C2.C(=O)(C(F)(F)F)O
    InChIKey
    ZJRMPPVJAQWGEG-FYZYNONXSA-N
    InChI
    1S/C22H28N4O4.C2HF3O2/c23-22(24)25-13-7-12-19(21(28)29)26-20(27)15-30-14-18(16-8-3-1-4-9-16)17-10-5-2-6-11-17;3-2(4,5)1(6)7/h1-6,8-11,18-19H,7,12-15H2show more
    Synonyms
    N2-[2-(2,2-Diphenylethoxy)acetyl]-L-arginine trifluoroacetate | N2-[2-(2,2-diphenylethoxy)acetyl]-L-arginine, 2,2,2-t...
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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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