By Target / Pathway / Disease

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. Fluoroclebopride
    CAS: 154540-49-5 Formula: C20H23ClFN3O2 Molecular Weight: 391.87
    ◐ .Made to order · 8–12 wks Item #: F412182
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    IUPAC Name
    4-amino-5-chloro-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methoxybenzamide
    SMILES
    COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=C(C=C3)F)Cl)N
    InChIKey
    HKDIGEWWDHALIS-UHFFFAOYSA-N
    InChI
    1S/C20H23ClFN3O2/c1-27-19-11-18(23)17(21)10-16(19)20(26)24-15-6-8-25(9-7-15)12-13-2-4-14(22)5-3-13/h2-5,10-11,15H,6-9,12,23H2,1H3,(H,24,26)
    Synonyms
    4-amino-5-chloro-N-(1-(4-fluorobenzyl)piperidin-4-yl)-2-methoxybenzamide | AKOS026751480 | N-{3-[2-({2,3-Difluoro-4-[...
  2. Fluorometholone, Glucocorticoid receptor agonist
    CAS: 426-13-1 EC Number: 207-041-5 Formula: C22H29FO4 Molecular Weight: 376.46
    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 #: F423928
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    IUPAC Name
    (6S,8S,9R,10S,11S,13S,14S,17R)-17-acetyl-9-fluoro-11,17-dihydroxy-6,10,13-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
    SMILES
    C[C@H]1C[C@H]2[C@@H]3CC[C@](O)(C(C)=O)[C@@]3(C)C[C@H](O)[C@]2(F)[C@@]4(C)C=CC(=O)C=C14
    InChIKey
    FAOZLTXFLGPHNG-KNAQIMQKSA-N
    InChI
    1S/C22H29FO4/c1-12-9-17-15-6-8-21(27,13(2)24)20(15,4)11-18(26)22(17,23)19(3)7-5-14(25)10-16(12)19/h5,7,10,12,15,17-18,26-27H,6,8-9,11H2,1-4H3/t12-,15-show more
    Synonyms
    9-Fluoro-11,17-dihydroxy-6-methylpregna-1,4-diene-3,20-dione | FML-S Liquifilm | Opera_ID_341 | FLUOROMETHOLONE [WHO-...
  3. Fluorometholone Acetate, Glucocorticoid receptor agonist
    CAS: 3801-06-7 EC Number: 223-270-3 Formula: C24H31FO5 Molecular Weight: 418.5
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: F423721
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    IUPAC Name
    [(6S,8S,9R,10S,11S,13S,14S,17R)-17-acetyl-9-fluoro-11-hydroxy-6,10,13-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] acshow more
    SMILES
    CC1CC2C3CCC(C3(CC(C2(C4(C1=CC(=O)C=C4)C)F)O)C)(C(=O)C)OC(=O)C
    InChIKey
    YRFXGQHBPBMFHW-SBTZIJSASA-N
    InChI
    1S/C24H31FO5/c1-13-10-19-17-7-9-23(14(2)26,30-15(3)27)22(17,5)12-20(29)24(19,25)21(4)8-6-16(28)11-18(13)21/h6,8,11,13,17,19-20,29H,7,9-10,12H2,1-5H3/tshow more
    Synonyms
    Flarex | AKOS025401542 | InChI=1/C18H19N/c1-2-3-4-5-15-6-10-17(11-7-15)18-12-8-16(14-19)9-13-18/h6-13H,2-5H2,1H | CHE...
  4. Fluoromethyl 1,1,1,3,3,3-Hexafluoroisopropyl Ether, Potassium channel subfamily K member 2 opener
    CAS: 28523-86-6 EC Number: 643-089-7 Formula: C4H3F7O Molecular Weight: 200.05
    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 #: F422995
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    IUPAC Name
    1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane
    SMILES
    C(OC(C(F)(F)F)C(F)(F)F)F
    InChIKey
    DFEYYRMXOJXZRJ-UHFFFAOYSA-N
    InChI
    1S/C4H3F7O/c5-1-12-2(3(6,7)8)4(9,10)11/h2H,1H2
    Synonyms
    sevoflurane|28523-86-6|1,1,1,3,3,3-Hexafluoro-2-(fluoromethoxy)propane|Sevofluran|Ultane|Sevorane|Sojourn|MR6S4|sevof...
  5. Fluorouracil (5-Fluorouracil, 5-FU), RNA inhibitor
    CAS: 51-21-8 EC Number: 200-085-6 Formula: C4H3FN2O2 Molecular Weight: 130.08
    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 #: F408985
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    Synonyms
    NSC 19893 | 5-​fluoro-2,​4(1H,​3H)​-​pyrimidinedione
  6. Fluoxetine (Lilly 110140) HCl, Serotonin transporter inhibitor
    CAS: 56296-78-7 EC Number: 260-101-2 PubChem CID: 62857 Formula: C17H18F3NO·HCl Molecular Weight: 345.79
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: F408308
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    Synonyms
    N-methyl-3-phenyl-3-(4-(trifluoromethyl)phenoxy)propan-1-amine hydrochloride
  7. Flupenthixol dihydrochloride
    CAS: 2413-38-9 EC Number: 219-321-4 PubChem CID: 5282483 Formula: C23H25F3N2OS.2HCl Molecular Weight: 507.44
    ● In Stock — US warehouse, ships to EU* Item #: F274688
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    IUPAC Name
    2-[4-[(3Z)-3-[2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]piperazin-1-yl]ethanol;dihydrochloride
    SMILES
    C1CN(CCN1CCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)CCO.Cl.Cl
    InChIKey
    IOVDQEIIMOZNNA-MHKBYHAFSA-N
    InChI
    1S/C23H25F3N2OS.2ClH/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29;;/h1-2,4-8,16,29H,3,9-15H2;2*1H/b18show more
    Synonyms
    1-PIPERAZINEETHANOL, 4-((3Z)-3-(2-(TRIFLUOROMETHYL)-9H-THIOXANTHEN-9-YLIDENE)PROPYL)-, DIHYDROCHLORIDE | s3664 | (E/Z...
  8. Fluphenazine decanoate, Dopamine D2 receptor antagonist
    CAS: 5002-47-1 Formula: C32H44F3N3O2S Molecular Weight: 591.78
    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 #: F353360
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    IUPAC Name
    2-[4-[3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazin-1-yl]ethyl decanoate
    SMILES
    CCCCCCCCCC(=O)OCCN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F
    InChIKey
    VIQCGTZFEYDQMR-UHFFFAOYSA-N
    InChI
    1S/C32H44F3N3O2S/c1-2-3-4-5-6-7-8-14-31(39)40-24-23-37-21-19-36(20-22-37)17-11-18-38-27-12-9-10-13-29(27)41-30-16-15-26(25-28(30)38)32(33,34)35/h9-10,show more
    Synonyms
    FLUPHENAZINE DECANOATE [WHO-DD] | QD-10733 | Prolixin decanoate (TN) | FLUPHENAZINE DECANOATE (USP IMPURITY) | BCP180...
  9. Fluvoxamine (DU-23000) maleate, Serotonin transporter inhibitor
    CAS: 61718-82-9 EC Number: 612-212-6 PubChem CID: 9560989 Formula: C15H21F3N2O2·C4H4O4 Molecular Weight: 434.41
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: F409149
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    Synonyms
    MK-264 | 1-Pentanone, 5-methoxy-1-[4-(trifluoromethyl)phenyl]-, O-(2-aminoethyl)oxime, (1E)-, (2Z)-2-butenedioate
  10. Flurbiprofen Axetil (mixture of diastereoisomers)
    CAS: 91503-79-6 EC Number: 842-261-0 Formula: C19H19FO4 Molecular Weight: 330.36
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: F426906
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    IUPAC Name
    1-acetyloxyethyl 2-(3-fluoro-4-phenylphenyl)propanoate
    SMILES
    CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)OC(C)OC(=O)C
    InChIKey
    ALIVXCSEERJYHU-UHFFFAOYSA-N
    InChI
    1S/C19H19FO4/c1-12(19(22)24-14(3)23-13(2)21)16-9-10-17(18(20)11-16)15-7-5-4-6-8-15/h4-12,14H,1-3H3
    Synonyms
    DB14938 | flurbiprofen axetil | NCGC00182710-01 | Ropion (TN) | CAS-91503-79-6 | Tox21_113023_1 | FP83 | FP-83 | Ropi...
  11. Fluticasone 17β-Carbonylsulfenic Acid 17-Propionate
    CAS: 948566-12-9 PubChem CID: 341109003 Formula: C24H30F2O6S Molecular Weight: 484.55
    ● In Stock — US warehouse, ships to EU* Item #: F336811
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    Synonyms
    (6α,11β,16α,17α)-6,9-Difluoro-11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)androsta-1,4-diene-17-carbo(thioperoxoic) A...
  12. Fluticasone Dimer Impurity
    CAS: 220589-37-7 EC Number: 863-880-2 PubChem CID: 71316902 Formula: C43H51F5O8S Molecular Weight: 822.92
    Solid ≥95%
    ● In Stock — US warehouse, ships to EU* Item #: F336809
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    IUPAC Name
    [(6S,8S,9R,10S,11S,13S,14S,16R,17R)-6,9-difluoro-17-(fluoromethylsulfanylcarbonyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocshow more
    SMILES
    CC1CC2C3CC(C4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)OC5(C(CC6C5(CC(C7(C6CC(C8=CC(=O)C=CC87C)F)F)O)C)C)C(=O)SCF)O)C)O)F)C)F
    InChIKey
    GTZKCEBOBPLPHH-AMISWYLQSA-N
    InChI
    1S/C43H51F5O8S/c1-20-11-24-26-15-30(45)28-13-22(49)7-9-36(28,3)40(26,47)32(51)17-38(24,5)42(20,55)34(53)56-43(35(54)57-19-44)21(2)12-25-27-16-31(46)29show more
    Synonyms
    [(6S,8S,9R,10S,11S,13S,14S,16R,17R)-6,9-difluoro-17-(fluoromethylsulfanylcarbonyl)-11-hydroxy-10,13,16-trimethyl-3-ox...
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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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