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. Fmoc-Phe-Lys(Trt)-PAB-PNP
    CAS: 1116086-09-9 PubChem CID: 118798952 Formula: C63H57N5O9 Molecular Weight: 1028.15
    ● In Stock — US warehouse, ships to EU* Item #: F412486
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    IUPAC Name
    [4-[[(2S)-1-amino-1-oxo-6-(tritylamino)hexan-2-yl]-[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanoyl]amino]phenyl]methyl (4-nitrophenyl)show more
    SMILES
    C1=CC=C(C=C1)CC(C(=O)N(C2=CC=C(C=C2)COC(=O)OC3=CC=C(C=C3)[N+](=O)[O-])C(CCCCNC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C(=O)N)NC(=O)OCC7C8=CC=CC=C8C9=CC=show more
    InChIKey
    LOGURWMJSNXIEZ-YQOHNZFASA-N
    InChI
    1S/C63H57N5O9/c64-59(69)58(31-17-18-40-65-63(46-21-7-2-8-22-46,47-23-9-3-10-24-47)48-25-11-4-12-26-48)67(49-34-32-45(33-35-49)42-76-62(72)77-51-38-36-show more
  2. Folinic acid
    CAS: 6035-45-6 Formula: C20H21CaN7O7.5H2O Molecular Weight: 601.59
    10mM in Water
    ● In Stock — US warehouse, ships to EU* Item #: F425013
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    IUPAC Name
    calcium;(2S)-2-[[4-[(2-amino-5-formyl-4-oxo-3,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioate;pentahydrate
    SMILES
    C1C(N(C2=C(N1)N=C(NC2=O)N)C=O)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)[O-])C(=O)[O-].O.O.O.O.O.[Ca+2]
    InChIKey
    NPPBLUASYYNAIG-ZIGBGYJWSA-L
    InChI
    1S/C20H23N7O7.Ca.5H2O/c21-20-25-16-15(18(32)26-20)27(9-28)12(8-23-16)7-22-11-3-1-10(2-4-11)17(31)24-13(19(33)34)5-6-14(29)30;;;;;;/h1-4,9,12-13,22H,5-show more
    Synonyms
    CALCII FOLINAS [WHO-IP LATIN] | 5H-Dibenz(b,f)azepine-5-propanamine, 10,11-dihydro-N,N,beta-trimethyl-, (+)-, (Z)-2-b...
  3. Folic acid
    ◐ .Made to order · 8–12 wks Item #: F413155
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    SMILES
    NC1=NC(=O)C2=C(N1)N=CC(=N2)CNC3=CC=C(C=C3)C(=O)NC(CCC(O)=O)C(O)=O
    Synonyms
    Folacin | Vitamin B9 | Vitamin M | Pteroylglutamic acid | Folate
  4. Foretinib (GSK1363089), Vascular endothelial growth factor receptor inhibitor
    CAS: 849217-64-7 EC Number: 629-893-0 Formula: C34H34F2N4O6 Molecular Weight: 632.65
    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 #: F407825
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    Synonyms
    EXEL-2880, XL-880, GSK089 | N-(3-fluoro-4-(6-methoxy-7-(3-morpholinopropoxy)quinolin-4-yloxy)phenyl)-N-(4-fluoropheny...
  5. Folinic acid
    CAS: 58-05-9 EC Number: 216-082-8, 200-361-6, 846-741-0 Formula: C₂₀H₂₃N₇O₇ Molecular Weight: 473.44
    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 #: F424873
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    IUPAC Name
    (2S)-2-[[4-[(2-amino-5-formyl-4-oxo-3,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
    SMILES
    C1C(N(C2=C(N1)N=C(NC2=O)N)C=O)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O
    InChIKey
    VVIAGPKUTFNRDU-ABLWVSNPSA-N
    InChI
    1S/C20H23N7O7/c21-20-25-16-15(18(32)26-20)27(9-28)12(8-23-16)7-22-11-3-1-10(2-4-11)17(31)24-13(19(33)34)5-6-14(29)30/h1-4,9,12-13,22H,5-8H2,(H,24,31)(show more
    Synonyms
    folinic acid|leucovorin|5-Formyltetrahydrofolic acid|folinate|58-05-9|Welcovorin|Leucal|Acide folinique|Folinic acid-...
  6. Formoterol Hemifumarate
    CAS: 43229-80-7 EC Number: 610-119-5 PubChem CID: 9832292 Formula: C19H24N2O4·1/2C4H4O4 Molecular Weight: 402.4
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: F409288
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    Synonyms
    Eformoterol, CGP 25827A, NSC 299587, YM 08316 | N-(2-hydroxy-5-((S)-1-hydroxy-2-((S)-1-(4-methoxyphenyl)propan-2-ylam...
  7. Foscarnet Sodium
    CAS: 63585-09-1 PubChem CID: 44561 Formula: CNa3O5P Molecular Weight: 191.95
    10mM in Water
    ● In Stock — US warehouse, ships to EU* Item #: F408966
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    Synonyms
    Phosphonoformate | Phosphinecarboxylic acid, 1,1-dihydroxy-, 1-oxide, sodium salt (1:3)
  8. Fosfluconazole
    CAS: 194798-83-9 Formula: C13H13F2N6O4P Molecular Weight: 386.25
    ● In Stock — US warehouse, ships to EU* Item #: F413468
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    IUPAC Name
    [2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-yl] dihydrogen phosphate
    SMILES
    C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)OP(=O)(O)O
    InChIKey
    GHJWNRRCRIGGIO-UHFFFAOYSA-N
    InChI
    1S/C13H13F2N6O4P/c14-10-1-2-11(12(15)3-10)13(25-26(22,23)24,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9H,4-5H2,(H2,22,23,24)
    Synonyms
    Q-102142 | UK 292663 | 1-(2,4-Difluorophenyl)-2-(1H-1,2,4-triazol-1-yl)-1-((1H-1,2,4-triazol-1-yl)methyl)ethyl dihydr...
  9. Fosphenytoin disodium salt, Sodium channel alpha subunit blocker
    CAS: 92134-98-0 EC Number: 618-823-4 Formula: C16H17N2Na2O7P Molecular Weight: 426.27
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: F426932
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    Synonyms
    5,5-Diphenyl-3-[(phosphonooxy)methyl]-2,4-imidazolidinedione disodium salt
  10. Fosamprenavir Calcium Salt, Human immunodeficiency virus type 1 protease inhibitor
    CAS: 226700-81-8 EC Number: 607-123-4 PubChem CID: 131535 Formula: C25H34CaN3O9PS Molecular Weight: 623.67
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: F422717
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    IUPAC Name
    calcium;[(2R,3S)-1-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-3-[[(3S)-oxolan-3-yl]oxycarbonylamino]-4-phenylbutan-2-yl] phosphate
    SMILES
    CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC2CCOC2)OP(=O)([O-])[O-])S(=O)(=O)C3=CC=C(C=C3)N.[Ca+2]
    InChIKey
    PMDQGYMGQKTCSX-HQROKSDRSA-L
    InChI
    1S/C25H36N3O9PS.Ca/c1-18(2)15-28(39(33,34)22-10-8-20(26)9-11-22)16-24(37-38(30,31)32)23(14-19-6-4-3-5-7-19)27-25(29)36-21-12-13-35-17-21;/h3-11,18,21,show more
    Synonyms
    Fosamprenavir calcium|226700-81-8|Fosamprenavir Calcium Salt|Lexiva|Telzir|Amprenavir phosphate calcium|Fosamprenavir...
  11. Fosaprepitant dimeglumine salt, Neurokinin 1 receptor antagonist
    CAS: 265121-04-8 PubChem CID: 135564864 Formula: C23H22F7N4O6P·2C7H17NO5 Molecular Weight: 1004.83
    10mM in DMSO
    ◐ .Made to order · 8–12 wks Item #: F408886
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    Synonyms
    MK-0517 | D-Glucitol, 1-deoxy-1-(methylamino)-, [3-[[(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-f...
  12. Fosfluconazole
    CAS: 194798-83-9 EC Number: 112-751-2 Formula: C13H13F2N6O4P Molecular Weight: 386.25
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: F422378
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    Technical Identifiers
    IUPAC Name
    [2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-yl] dihydrogen phosphate
    SMILES
    C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)OP(=O)(O)O
    InChIKey
    GHJWNRRCRIGGIO-UHFFFAOYSA-N
    InChI
    1S/C13H13F2N6O4P/c14-10-1-2-11(12(15)3-10)13(25-26(22,23)24,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9H,4-5H2,(H2,22,23,24)
    Synonyms
    Q-102142 | UK 292663 | 1-(2,4-Difluorophenyl)-2-(1H-1,2,4-triazol-1-yl)-1-((1H-1,2,4-triazol-1-yl)methyl)ethyl dihydr...
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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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