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).

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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

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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. Chlorhexidine
    CAS: 55-56-1 EC Number: 200-238-7 Formula: C22H30Cl2N10 Molecular Weight: 505.45
    Liquid 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: C424729
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    Technical Identifiers
    IUPAC Name
    (1E)-2-[6-[[amino-[(E)-[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine
    SMILES
    C1=CC(=CC=C1NC(=NC(=NCCCCCCN=C(N)N=C(N)NC2=CC=C(C=C2)Cl)N)N)Cl
    InChIKey
    GHXZTYHSJHQHIJ-UHFFFAOYSA-N
    InChI
    1S/C22H30Cl2N10/c23-15-5-9-17(10-6-15)31-21(27)33-19(25)29-13-3-1-2-4-14-30-20(26)34-22(28)32-18-11-7-16(24)8-12-18/h5-12H,1-4,13-14H2,(H5,25,27,29,31show more
    Synonyms
    chlorhexidine|55-56-1|Rotersept|Fimeil|Hexadol|Soretol|Chlorhexidin|Chlorhexidinum|Cloresidina [DCIT]|Chlorhexidin [C...
  2. Chloroprocaine HCl, Sodium channel alpha subunit blocker
    CAS: 3858-89-7 PubChem CID: 441348 Formula: C13H20Cl2N2O2 Molecular Weight: 307.22
    ● In Stock — US warehouse, ships to EU* Item #: C413096
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    IUPAC Name
    2-(diethylamino)ethyl 4-amino-2-chlorobenzoate;hydrochloride
    SMILES
    CCN(CC)CCOC(=O)C1=C(C=C(C=C1)N)Cl.Cl
    InChIKey
    SZKQYDBPUCZLRX-UHFFFAOYSA-N
    InChI
    1S/C13H19ClN2O2.ClH/c1-3-16(4-2)7-8-18-13(17)11-6-5-10(15)9-12(11)14;/h5-6,9H,3-4,7-8,15H2,1-2H3;1H
    Synonyms
    NCGC00183273-01 | (CHLOROPROCAINE HCI | B2867 | A912305 | CHLOROPROCAINE HYDROCHLORIDE [USP-RS] | chloroprocaine hydr...
  3. Chloroprocaine HCl, Sodium channel alpha subunit blocker
    CAS: 3858-89-7 EC Number: 223-371-2 PubChem CID: 441348 Formula: C13H20Cl2N2O2 Molecular Weight: 307.22
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: C423788
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    IUPAC Name
    2-(diethylamino)ethyl 4-amino-2-chlorobenzoate;hydrochloride
    SMILES
    CCN(CC)CCOC(=O)C1=C(C=C(C=C1)N)Cl.Cl
    InChIKey
    SZKQYDBPUCZLRX-UHFFFAOYSA-N
    InChI
    1S/C13H19ClN2O2.ClH/c1-3-16(4-2)7-8-18-13(17)11-6-5-10(15)9-12(11)14;/h5-6,9H,3-4,7-8,15H2,1-2H3;1H
    Synonyms
    NCGC00183273-01 | (CHLOROPROCAINE HCI | B2867 | A912305 | CHLOROPROCAINE HYDROCHLORIDE [USP-RS] | chloroprocaine hydr...
  4. Chloroquine, Agonist of MRGPRX1;Agonist of TAS2R3
    CAS: 54-05-7 EC Number: 200-191-2 Formula: C18H26ClN3 Molecular Weight: 319.87
    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 #: C424619
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    IUPAC Name
    4-N-(7-chloroquinolin-4-yl)-1-N,1-N-diethylpentane-1,4-diamine
    SMILES
    CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl
    InChIKey
    WHTVZRBIWZFKQO-UHFFFAOYSA-N
    InChI
    1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)
    Synonyms
    chloroquine|54-05-7|Aralen|Chlorochin|Chloraquine|Artrichin|Chloroquina|Chloroquinium|Capquin|Reumachlor|Chemochin|Ch...
  5. Chloroquine Sulphate
    CAS: 132-73-0 EC Number: 205-077-6 Formula: C18H28ClN3O4S Molecular Weight: 417.95
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    ◐ .Made to order · 8–12 wks Item #: C349192
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    IUPAC Name
    4-N-(7-chloroquinolin-4-yl)-1-N,1-N-diethylpentane-1,4-diamine;sulfuric acid
    SMILES
    CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl.OS(=O)(=O)O
    InChIKey
    OJPWHUOVKVKBQB-UHFFFAOYSA-N
    InChI
    1S/C18H26ClN3.H2O4S/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18;1-5(2,3)4/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21);(H2,1,2,3,4)
    Synonyms
    5-(4-Chlorobuty)-1-cyclohexyltetrazol | 7-Chloro-4-((4-(diethylamino)-1-methylbutyl)amino)quinoline sulfate (1:1) | 7...
  6. Chlorobis(4-chlorophenyl)phosphine
    CAS: 13685-26-2 Formula: C12H8Cl3P Molecular Weight: 289.52
    ● In Stock — US warehouse, ships to EU* Item #: C348935
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    IUPAC Name
    chloro-bis(4-chlorophenyl)phosphane
    SMILES
    C1=CC(=CC=C1P(C2=CC=C(C=C2)Cl)Cl)Cl
    InChIKey
    UISLTICQIVPVGS-UHFFFAOYSA-N
    InChI
    1S/C12H8Cl3P/c13-9-1-5-11(6-2-9)16(15)12-7-3-10(14)4-8-12/h1-8H
    Synonyms
    Phosphinous chloride, bis(4-chlorophenyl)- (9CI) | MFCD09909564 | SCHEMBL2154365 | AKOS030612235 | Bis(4-chlorophenyl...
  7. Chlorobis[4-(trifluoromethyl)phenyl]phosphine
    CAS: 13685-24-0 EC Number: 679-116-4 Formula: C14H8ClF6P Molecular Weight: 356.64
    Liquid ≥97%
    ● In Stock — US warehouse, ships to EU* Item #: C348937
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    IUPAC Name
    chloro-bis[4-(trifluoromethyl)phenyl]phosphane
    SMILES
    C1=CC(=CC=C1C(F)(F)F)P(C2=CC=C(C=C2)C(F)(F)F)Cl
    InChIKey
    PBLUOOURLNAOAJ-UHFFFAOYSA-N
    InChI
    1S/C14H8ClF6P/c15-22(11-5-1-9(2-6-11)13(16,17)18)12-7-3-10(4-8-12)14(19,20)21/h1-8H
    Synonyms
    Bis[4-(trifluoromethyl)phenyl]chlorophosphine | Chloro-bis[4-(trifluoromethyl)phenyl]phosphane
  8. Dibromochloroacetaldehyde
    CAS: 64316-11-6 Formula: C2HBr2ClO•(H2O) Molecular Weight: 236.29
    ● In Stock — US warehouse, ships to EU* Item #: C388500
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    IUPAC Name
    2,2-dibromo-2-chloroacetaldehyde
    SMILES
    C(=O)C(Cl)(Br)Br
    InChIKey
    SFWAQPWRFZOPKA-UHFFFAOYSA-N
    InChI
    1S/C2HBr2ClO/c3-2(4,5)1-6/h1H
    Synonyms
    SFWAQPWRFZOPKA-UHFFFAOYSA-N | Chlorodibromoacetaldehyde | Dibromchloracetaldehyd | Dibromo(chloro)acetaldehyde | dibr...
  9. Chlorogenic acid
    CAS: 327-97-9 EC Number: 206-325-6 PubChem CID: 1794427 Formula: C16H18O9 Molecular Weight: 354.31
    Solid 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 #: C109404
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    IUPAC Name
    (1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid
    SMILES
    O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O)C(O)=O
    InChIKey
    CWVRJTMFETXNAD-JUHZACGLSA-N
    InChI
    1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/show more
    Synonyms
    (1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylicacid | 3-(3,4-Di...
  10. Chlorofluoroacetic acid
    CAS: 471-44-3 Formula: C2H2ClFO2 Molecular Weight: 112.49
    ● In Stock — US warehouse, ships to EU* Item #: C349189
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    IUPAC Name
    2-chloro-2-fluoroacetic acid
    SMILES
    C(C(=O)O)(F)Cl
    InChIKey
    JBIKZDFUXGHTHD-UHFFFAOYSA-N
    InChI
    1S/C2H2ClFO2/c3-1(4)2(5)6/h1H,(H,5,6)
    Synonyms
    2-chloro-2-fluoroacetic acid | AKOS006343239 | MFCD19228891 | SY276751 | FT-0676800 | MFCD00871521 | MFCD19229828 | S...
  11. Chlorotetracycline
    CAS: 57-62-5 EC Number: 200-341-7 Formula: C22H23ClN2O8 Molecular Weight: 478.88
    Liquid 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: C424848
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    IUPAC Name
    (4S,4aS,5aS,6S,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide
    SMILES
    CC1(C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C(C=CC(=C41)Cl)O)O)O)O)C(=O)N)N(C)C)O
    InChIKey
    DHPRQBPJLMKORJ-XRNKAMNCSA-N
    InChI
    1S/C22H23ClN2O8/c1-21(32)7-6-8-15(25(2)3)17(28)13(20(24)31)19(30)22(8,33)18(29)11(7)16(27)12-10(26)5-4-9(23)14(12)21/h4-5,7-8,15,26-27,30,32-33H,6H2,1show more
    Synonyms
    Spectrum3_000348 | Spectrum5_000461 | Uromycin | Acronize | chlortetracycline | KBio1_000253 | Aureomycin (TN) | Casw...
  12. Cholesterol Margarate
    CAS: 24365-37-5 Formula: C44H78O2 Molecular Weight: 639.11
    ● In Stock — US warehouse, ships to EU* Item #: C303173
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    IUPAC Name
    [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hshow more
    SMILES
    CCCCCCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C
    InChIKey
    PPQNZVDOBYGOLY-BFGJSWSOSA-N
    InChI
    1S/C44H78O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-42(45)46-37-29-31-43(5)36(33-37)25-26-38-40-28-27-39(35(4)23-21-22-34(2)3)44(40,6)32-30-41(38show more
    Synonyms
    A877953 | CHOLESTERYLHEPTADECANOATE | PPQNZVDOBYGOLY-BFGJSWSOSA-N | SCHEMBL1367882 | cholest-5-en-3beta-yl heptadecan...
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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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