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. Oxacillin sodium salt
    CAS: 1173-88-2 Formula: C19H18N3NaO5S Molecular Weight: 423.42
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: O420778
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    Technical Identifiers
    IUPAC Name
    sodium;(2S,5R,6R)-3,3-dimethyl-6-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
    SMILES
    CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)[O-].[Na+]
    InChIKey
    VDUVBBMAXXHEQP-SLINCCQESA-M
    InChI
    1S/C19H19N3O5S.Na/c1-9-11(12(21-27-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)28-17(13)22;/h4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26);/q;+show more
    Synonyms
    Oxacillin sodium salt|OXACILLIN SODIUM|1173-88-2|Sodium oxacillin|Bactocill|Oxabel|Micropenin|Prostaphlin|Bristopen|O...
  2. Oxcarbazepine, Sodium channel alpha subunit blocker
    CAS: 28721-07-5 EC Number: 249-188-8 Formula: C15H12N2O2 Molecular Weight: 252.27
    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 #: O407773
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    Synonyms
    GP47680 | 10,11-Dihydro-10-oxo-5H-dibenz[b,f]azepine-5-carboxamide
  3. Oxypeucedanin
    CAS: 737-52-0 EC Number: 801-753-5 Formula: C16H14O5 Molecular Weight: 286.28
    ● In Stock — US warehouse, ships to EU* Item #: O414374
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    IUPAC Name
    4-[(3,3-dimethyloxiran-2-yl)methoxy]furo[3,2-g]chromen-7-one
    SMILES
    CC1(C(O1)COC2=C3C=CC(=O)OC3=CC4=C2C=CO4)C
    InChIKey
    QTAGQHZOLRFCBU-UHFFFAOYSA-N
    InChI
    1S/C16H14O5/c1-16(2)13(21-16)8-19-15-9-3-4-14(17)20-12(9)7-11-10(15)5-6-18-11/h3-7,13H,8H2,1-2H3
    Synonyms
    CHEBI:174722 | MFCD00419546 | MLS000856077 | OXYPEUCEDANIN, (+/-)- | BDBM50587272 | 4-[(3,3-dimethyloxiran-2-yl)metho...
  4. Oxytocin acetate
    CAS: 6233-83-6 PubChem CID: 12004215 Formula: C45H70N12O14S2 Molecular Weight: 1067.24
    ● In Stock — US warehouse, ships to EU* Item #: O409461
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    IUPAC Name
    acetic acid;(2S)-1-[(4R,7S,10S,13S,16S,19R)-19-amino-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-16-[(4-hydroxyphenyl)methyl]show more
    SMILES
    CCC(C)C1C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)N1)CC2=CC=C(C=C2)O)N)C(=O)N3CCCC3C(=O)NC(CC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N.CC(=O)O
    InChIKey
    DSZOEVVLZMNAEH-BXUJZNQYSA-N
    InChI
    1S/C43H66N12O12S2.C2H4O2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8show more
    Synonyms
    Oxytocin, monoacetate (salt) | AT13256 | Orasthin; Ossitocina | Q27260257 | DSZOEVVLZMNAEH-BXUJZNQYSA-N | 4NR672T8NL ...
  5. Oxypaeoniflorin
    CAS: 39011-91-1 Formula: C23H28O12 Molecular Weight: 496.46
    ● In Stock — US warehouse, ships to EU* Item #: O412642
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    IUPAC Name
    [(1R,2S,3R,5R,6R,8S)-6-hydroxy-8-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decanshow more
    SMILES
    CC12CC3(C4CC1(C4(C(O2)O3)COC(=O)C5=CC=C(C=C5)O)OC6C(C(C(C(O6)CO)O)O)O)O
    InChIKey
    FCHVXNVDFYXLIL-WRJNSLSBSA-N
    InChI
    1S/C23H28O12/c1-20-8-22(30)13-6-23(20,33-18-16(28)15(27)14(26)12(7-24)32-18)21(13,19(34-20)35-22)9-31-17(29)10-2-4-11(25)5-3-10/h2-5,12-16,18-19,24-28show more
    Synonyms
    A873733 | .BETA.-D-GLUCOPYRANOSIDE, TETRAHYDRO-5-HYDROXY-5B-(((4-HYDROXYBENZOYL)OXY)METHYL)-2-METHYL-2,5-METHANO-1H-3...
  6. Oxypeucedanin
    CAS: 737-52-0 EC Number: 801-753-5 Formula: C16H14O5 Molecular Weight: 286.28
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: O425754
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    IUPAC Name
    4-[(3,3-dimethyloxiran-2-yl)methoxy]furo[3,2-g]chromen-7-one
    SMILES
    CC1(C(O1)COC2=C3C=CC(=O)OC3=CC4=C2C=CO4)C
    InChIKey
    QTAGQHZOLRFCBU-UHFFFAOYSA-N
    InChI
    1S/C16H14O5/c1-16(2)13(21-16)8-19-15-9-3-4-14(17)20-12(9)7-11-10(15)5-6-18-11/h3-7,13H,8H2,1-2H3
    Synonyms
    CHEBI:174722 | MFCD00419546 | MLS000856077 | OXYPEUCEDANIN, (+/-)- | BDBM50587272 | 4-[(3,3-dimethyloxiran-2-yl)metho...
  7. Oxyphenbutazone
    CAS: 129-20-4 Formula: C19H20N2O3 Molecular Weight: 324.37
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: O342424
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    IUPAC Name
    4-butyl-1-(4-hydroxyphenyl)-2-phenylpyrazolidine-3,5-dione
    SMILES
    CCCCC1C(=O)N(N(C1=O)C2=CC=C(C=C2)O)C3=CC=CC=C3
    InChIKey
    HFHZKZSRXITVMK-UHFFFAOYSA-N
    InChI
    1S/C19H20N2O3/c1-2-3-9-17-18(23)20(14-7-5-4-6-8-14)21(19(17)24)15-10-12-16(22)13-11-15/h4-8,10-13,17,22H,2-3,9H2,1H3
    Synonyms
    G-27202 | NSC-757261 | Oxyphenbutazone [INN] | OXYPHENBUTAZONE ANHYDROUS, (+/-)- | Telidac | Metabolite I | Butilene ...
  8. Oxyphenisatine
    CAS: 125-13-3 EC Number: 204-728-1 Formula: C20H15NO3 Molecular Weight: 317.34
    ● In Stock — US warehouse, ships to EU* Item #: O302295
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    IUPAC Name
    3,3-bis(4-hydroxyphenyl)-1H-indol-2-one
    SMILES
    C1=CC=C2C(=C1)C(C(=O)N2)(C3=CC=C(C=C3)O)C4=CC=C(C=C4)O
    InChIKey
    SJDACOMXKWHBOW-UHFFFAOYSA-N
    InChI
    1S/C20H15NO3/c22-15-9-5-13(6-10-15)20(14-7-11-16(23)12-8-14)17-3-1-2-4-18(17)21-19(20)24/h1-12,22-23H,(H,21,24)
    Synonyms
    EINECS 204-728-1 | OXYPHENISATINE [WHO-DD] | BRN 0286070 | Diphenolisatin | Oxyphenisatine [INN:BAN] | HY-B2102 | Hos...
  9. Oxyclozanide
    CAS: 2277-92-1 Formula: C13H6Cl5NO3 Molecular Weight: 401.46
    ● In Stock — US warehouse, ships to EU* Item #: O332465
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    Technical Identifiers
    IUPAC Name
    2,3,5-trichloro-N-(3,5-dichloro-2-hydroxyphenyl)-6-hydroxybenzamide
    SMILES
    C1=C(C=C(C(=C1NC(=O)C2=C(C(=CC(=C2Cl)Cl)Cl)O)O)Cl)Cl
    InChIKey
    JYWIYHUXVMAGLG-UHFFFAOYSA-N
    InChI
    1S/C13H6Cl5NO3/c14-4-1-6(16)11(20)8(2-4)19-13(22)9-10(18)5(15)3-7(17)12(9)21/h1-3,20-21H,(H,19,22)
    Synonyms
    BRN 2014120 | ICI 46638 | Oxyclosanid-13C6 | 3,3',5,5',6-Pentachloro-2'-hydroxysalicylanilide | ICI 46683 | SMR004701...
  10. Oxyclozanide
    CAS: 2277-92-1 EC Number: 218-904-0 Formula: C13H6Cl5NO3 Molecular Weight: 401.46
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: O422721
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    Technical Identifiers
    IUPAC Name
    2,3,5-trichloro-N-(3,5-dichloro-2-hydroxyphenyl)-6-hydroxybenzamide
    SMILES
    C1=C(C=C(C(=C1NC(=O)C2=C(C(=CC(=C2Cl)Cl)Cl)O)O)Cl)Cl
    InChIKey
    JYWIYHUXVMAGLG-UHFFFAOYSA-N
    InChI
    1S/C13H6Cl5NO3/c14-4-1-6(16)11(20)8(2-4)19-13(22)9-10(18)5(15)3-7(17)12(9)21/h1-3,20-21H,(H,19,22)
    Synonyms
    BRN 2014120 | ICI 46638 | Oxyclosanid-13C6 | 3,3',5,5',6-Pentachloro-2'-hydroxysalicylanilide | ICI 46683 | SMR004701...
  11. P5091 (P005091)
    CAS: 882257-11-6 EC Number: 804-542-6 PubChem CID: 2819993 Formula: C12H7Cl2NO3S2 Molecular Weight: 348.23
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: P408720
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    Technical Identifiers
    Synonyms
    Ethanone, 1-[5-[(2,3-dichlorophenyl)thio]-4-nitro-2-thienyl]-
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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.
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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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