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. Encenicline (EVP-6124) hydrochloride
    CAS: 550999-74-1 PubChem CID: 46208542 Formula: C16H18Cl2N2OS Molecular Weight: 357.3
    ● In Stock — US warehouse, ships to EU* Item #: E412827
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    IUPAC Name
    N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-7-chloro-1-benzothiophene-2-carboxamide;hydrochloride
    SMILES
    C1CN2CCC1C(C2)NC(=O)C3=CC4=C(S3)C(=CC=C4)Cl.Cl
    InChIKey
    OIJYTJGIDVTCFF-ZOWNYOTGSA-N
    InChI
    1S/C16H17ClN2OS.ClH/c17-12-3-1-2-11-8-14(21-15(11)12)16(20)18-13-9-19-6-4-10(13)5-7-19;/h1-3,8,10,13H,4-7,9H2,(H,18,20);1H/t13-;/m0./s1
    Synonyms
    EVP-6124 (hydrochloride) | (R)-7-chloro-N-(quinuclidin-3-yl)benzo[b]thiophene-2-carboxamide hydrochloride. | B2929 | ...
  2. Enclomiphene citrate
    CAS: 7599-79-3 Formula: C32H36ClNO8 Molecular Weight: 598.08
    ● In Stock — US warehouse, ships to EU* Item #: T345380
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    IUPAC Name
    2-[4-[(E)-2-chloro-1,2-diphenylethenyl]phenoxy]-N,N-diethylethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid
    SMILES
    CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
    InChIKey
    PYTMYKVIJXPNBD-BTKVJIOYSA-N
    InChI
    1S/C26H28ClNO.C6H8O7/c1-3-28(4-2)19-20-29-24-17-15-22(16-18-24)25(21-11-7-5-8-12-21)26(27)23-13-9-6-10-14-23;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-18H,3-4,show more
    Synonyms
    Androxal | 2-[4-[(E)-2-chloranyl-1,2-diphenyl-ethenyl]phenoxy]-N,N-diethyl-ethanamine; 2-oxidanylpropane-1,2,3-tricar...
  3. Elsulfavirine
    CAS: 868046-19-9 Formula: C24H17BrCl2FN3O5S Molecular Weight: 629.28
    Solid ≥98%
    ◐ .Made to order · 8–12 wks Item #: E413414
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    IUPAC Name
    N-[4-[[2-[4-bromo-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl]acetyl]amino]-3-chlorophenyl]sulfonylpropanamide
    SMILES
    CCC(=O)NS(=O)(=O)C1=CC(=C(C=C1)NC(=O)CC2=C(C(=C(C=C2)Br)OC3=CC(=CC(=C3)C#N)Cl)F)Cl
    InChIKey
    ULTDEARCBRNRGR-UHFFFAOYSA-N
    InChI
    1S/C24H17BrCl2FN3O5S/c1-2-21(32)31-37(34,35)17-4-6-20(19(27)11-17)30-22(33)9-14-3-5-18(25)24(23(14)28)36-16-8-13(12-29)7-15(26)10-16/h3-8,10-11H,2,9H2show more
    Synonyms
    AT14358 | HY-109056 | Benzeneacetamide, 4-bromo-3-(3-chloro-5-cyanophenoxy)-N-(2-chloro-4-(((1-oxopropyl)amino)sulfon...
  4. Eltrombopag (SB497115) Olamine, Thrombopoietin receptor agonist
    CAS: 496775-62-3 EC Number: 629-876-8 Formula: C29H36N6O6 Molecular Weight: 564.63
    Solid ≥99%
    ● In Stock — US warehouse, ships to EU* Item #: E412775
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    IUPAC Name
    2-aminoethanol;3-[3-[[2-(3,4-dimethylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]diazenyl]-2-hydroxyphenyl]benzoic acid
    SMILES
    CC1=C(C=C(C=C1)N2C(=O)C(=C(N2)C)N=NC3=CC=CC(=C3O)C4=CC(=CC=C4)C(=O)O)C.C(CO)N.C(CO)N
    InChIKey
    DJMJHIKGMVJYCW-UHFFFAOYSA-N
    InChI
    1S/C25H22N4O4.2C2H7NO/c1-14-10-11-19(12-15(14)2)29-24(31)22(16(3)28-29)27-26-21-9-5-8-20(23(21)30)17-6-4-7-18(13-17)25(32)33;2*3-1-2-4/h4-13,28,30H,1-show more
    Synonyms
    2-Aminoethanol (E)-3'-(2-(1-(3,4-dimethylphenyl)-3-methyl-5-oxo-1H-pyrazol-4(5H)-ylidene)hydrazinyl)-2'-hydroxy-[1,1'...
  5. Emavusertib (CA-4948), Inhibitor of interleukin 1 receptor associated kinase 4
    CAS: 1801344-14-8 Formula: C24H25N7O5 Molecular Weight: 491.5
    Liquid 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 #: E422201
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    IUPAC Name
    N-[5-[(3R)-3-hydroxypyrrolidin-1-yl]-2-morpholin-4-yl-[1,3]oxazolo[4,5-b]pyridin-6-yl]-2-(2-methylpyridin-4-yl)-1,3-oxazole-4-carboxamide
    SMILES
    CC1=NC=CC(=C1)C2=NC(=CO2)C(=O)NC3=CC4=C(N=C3N5CCC(C5)O)N=C(O4)N6CCOCC6
    InChIKey
    SJHNWSAWWOAWJH-MRXNPFEDSA-N
    InChI
    1S/C24H25N7O5/c1-14-10-15(2-4-25-14)23-27-18(13-35-23)22(33)26-17-11-19-20(28-21(17)31-5-3-16(32)12-31)29-24(36-19)30-6-8-34-9-7-30/h2,4,10-11,13,16,3show more
    Synonyms
    GTPL10152 | RCRA waste no. P108 | AU4948 | AU-4948 | 4-Oxazolecarboxamide, N-(5-((3R)-3-hydroxy-1-pyrrolidinyl)-2-(4-...
  6. Emedastine
    CAS: 87233-61-2 Formula: C17H26N4O Molecular Weight: 302.41
    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 #: E426593
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    IUPAC Name
    1-(2-ethoxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)benzimidazole
    SMILES
    CCOCCN1C2=CC=CC=C2N=C1N3CCCN(CC3)C
    InChIKey
    KBUZBQVCBVDWKX-UHFFFAOYSA-N
    InChI
    1S/C17H26N4O/c1-3-22-14-13-21-16-8-5-4-7-15(16)18-17(21)20-10-6-9-19(2)11-12-20/h4-5,7-8H,3,6,9-14H2,1-2H3
    Synonyms
    1-(2-ethoxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)-1H-1,3-benzodiazole | 1-(2-Ethoxy-ethyl)-2-(4-methyl-[1,4]diazepan-1...
  7. Emepronium Bromide
    CAS: 3614-30-0 Formula: C20H28BrN Molecular Weight: 362.35
    ◐ .Made to order · 8–12 wks Item #: E335704
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    IUPAC Name
    4,4-diphenylbutan-2-yl-ethyl-dimethylazanium;bromide
    SMILES
    CC[N+](C)(C)C(C)CC(C1=CC=CC=C1)C2=CC=CC=C2.[Br-]
    InChIKey
    UVKFSMBPRQBNCH-UHFFFAOYSA-M
    InChI
    1S/C20H28N.BrH/c1-5-21(3,4)17(2)16-20(18-12-8-6-9-13-18)19-14-10-7-11-15-19;/h6-15,17,20H,5,16H2,1-4H3;1H/q+1;/p-1
    Synonyms
    Emeproniumbromid [German] | Ripirin | DTXSID50875265 | Ammonium, ethyldimethyl(1-methyl-3,3-diphenylpropyl)-, bromide...
  8. Enpp-1-IN-1
    CAS: 2289728-58-9 Formula: C17H17N3O3S Molecular Weight: 343.4
    ● In Stock — US warehouse, ships to EU* Item #: E412425
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    IUPAC Name
    7-methoxy-4-[4-[(sulfamoylamino)methyl]phenyl]quinoline
    SMILES
    COC1=CC2=NC=CC(=C2C=C1)C3=CC=C(C=C3)CNS(=O)(=O)N
    InChIKey
    UEJMNZDIQDULLP-UHFFFAOYSA-N
    InChI
    1S/C17H17N3O3S/c1-23-14-6-7-16-15(8-9-19-17(16)10-14)13-4-2-12(3-5-13)11-20-24(18,21)22/h2-10,20H,11H2,1H3,(H2,18,21,22)
    Synonyms
    UUN28589 | MV 658Sulfamide,N-​[[4-​(7-​methoxy-​4-​quinolinyl)​phenyl]​methyl]​-
  9. Ellagic Acid hydrate
    CAS: 314041-08-2 Formula: C14H6O8.H2O Molecular Weight: 320.21
    Liquid 2mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: E423250
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    IUPAC Name
    6,7,13,14-tetrahydroxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione;hydrate
    SMILES
    C1=C2C3=C(C(=C1O)O)OC(=O)C4=CC(=C(C(=C43)OC2=O)O)O.O
    InChIKey
    UOZZJRXBNGVIKO-UHFFFAOYSA-N
    InChI
    1S/C14H6O8.H2O/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19;/h1-2,15-18H;1H2
    Synonyms
    [1]​Benzopyrano[5,​4,​3-​cde]​[1]​benzopyran-​5,​10-​dione,2,​3,​7,​8-​tetrahydroxy-​,monohydrate (9CI)
  10. Ellipticine hydrochloride
    CAS: 5081-48-1 Formula: C17H15ClN2 Molecular Weight: 282.77
    ● In Stock — US warehouse, ships to EU* Item #: E413636
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    IUPAC Name
    5,11-dimethyl-6H-pyrido[4,3-b]carbazole;hydrochloride
    SMILES
    CC1=C2C=CN=CC2=C(C3=C1NC4=CC=CC=C43)C.Cl
    InChIKey
    VSBNVARERCGCEF-UHFFFAOYSA-N
    InChI
    1S/C17H14N2.ClH/c1-10-14-9-18-8-7-12(14)11(2)17-16(10)13-5-3-4-6-15(13)19-17;/h3-9,19H,1-2H3;1H
    Synonyms
    Q27254611 | 5,11-dimethyl-6H-pyrido[4,3-b]carbazole;hydrochloride | BS-17160 | NSC71795 hydrochloride | D71154 | 5,11...
  11. Eltrombopag, Agonist of Thrombopoietin receptor
    CAS: 496775-61-2 EC Number: 610-469-9 Formula: C25H22N4O4 Molecular Weight: 442.47
    Liquid 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 #: E424282
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    IUPAC Name
    3-[3-[[2-(3,4-dimethylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]diazenyl]-2-hydroxyphenyl]benzoic acid
    SMILES
    CC1=C(C=C(C=C1)N2C(=O)C(=C(N2)C)N=NC3=CC=CC(=C3O)C4=CC(=CC=C4)C(=O)O)C
    InChIKey
    SVOQIEJWJCQGDQ-UHFFFAOYSA-N
    InChI
    1S/C25H22N4O4/c1-14-10-11-19(12-15(14)2)29-24(31)22(16(3)28-29)27-26-21-9-5-8-20(23(21)30)17-6-4-7-18(13-17)25(32)33/h4-13,28,30H,1-3H3,(H,32,33)
    Synonyms
    BCP9000641 | D02363 | CHEBI:85010 | EN300-1709152 | XDXWLKQMMKQXPV-UHFFFAOYSA-N | SB497115 | SB-497115 | 3'-[(2Z)- [1...
  12. Eltrombopag (SB497115) Olamine, Thrombopoietin receptor agonist
    CAS: 496775-62-3 EC Number: 629-876-8 Formula: C29H36N6O6 Molecular Weight: 564.63
    Liquid 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: E407823
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    Technical Identifiers
    Synonyms
    SB-497115-GR | 3'-[(2Z)-2-[1-(3,4-dimethylphenyl)-1,5-dihydro-3-methyl-5-oxo-4H-pyrazol-4-ylidene]hydrazinyl]-2'-hydr...
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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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