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. Erianin
    CAS: 95041-90-0 Formula: C18H22O5 Molecular Weight: 318.36
    Solid ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: E414341
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    Technical Identifiers
    IUPAC Name
    2-methoxy-5-[2-(3,4,5-trimethoxyphenyl)ethyl]phenol
    SMILES
    COC1=C(C=C(C=C1)CCC2=CC(=C(C(=C2)OC)OC)OC)O
    InChIKey
    UXDFUVFNIAJEGM-UHFFFAOYSA-N
    InChI
    1S/C18H22O5/c1-20-15-8-7-12(9-14(15)19)5-6-13-10-16(21-2)18(23-4)17(11-13)22-3/h7-11,19H,5-6H2,1-4H3
    Synonyms
    5-(3,4,5-trimethoxyphenethyl)-2-methoxyphenol | DTXSID40326751 | UXDFUVFNIAJEGM-UHFFFAOYSA-N | NSC-613744 | FT-060870...
  2. Erastin
    CAS: 571203-78-6 Formula: C30H31ClN4O4 Molecular Weight: 547.04
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: E424821
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    IUPAC Name
    2-[1-[4-[2-(4-chlorophenoxy)acetyl]piperazin-1-yl]ethyl]-3-(2-ethoxyphenyl)quinazolin-4-one
    SMILES
    CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2C(C)N4CCN(CC4)C(=O)COC5=CC=C(C=C5)Cl
    InChIKey
    BKQFRNYHFIQEKN-UHFFFAOYSA-N
    InChI
    1S/C30H31ClN4O4/c1-3-38-27-11-7-6-10-26(27)35-29(32-25-9-5-4-8-24(25)30(35)37)21(2)33-16-18-34(19-17-33)28(36)20-39-23-14-12-22(31)13-15-23/h4-15,21H,show more
    Synonyms
    C21478 | EX-A295 | s7242 | BCP27907 | ZJA3NS42T9 | 4(3H)-Quinazolinone, 2-[1-[4-[2-(4-chlorophenoxy)acetyl]-1-piperaz...
  3. Erdafitinib (JNJ-42756493), Inhibitor of fibroblast growth factor receptor 1;Inhibitor of fibroblast growth factor receptor 2;Inhibitor of fibroblast growth factor receptor 3;Inhibitor of fibroblast growth factor receptor 4;Inhibitor of kinase insert domain receptor
    CAS: 1346242-81-6 EC Number: 807-395-6 Formula: C25H30N6O2 Molecular Weight: 446.54
    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 #: E409267
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    Synonyms
    1,​2-​Ethanediamine, N1-​(3,​5-​dimethoxyphenyl)​-​N2-​(1-​methylethyl)​-​N1-​[3-​(1-​methyl-​1H-​pyrazol-​4-​yl)​-​6-�...
  4. Ertugliflozin L-pyroglutamic acid
    CAS: 1210344-83-4 PubChem CID: 57339449 Formula: C27H32ClNO10 Molecular Weight: 566
    ● In Stock — US warehouse, ships to EU* Item #: E413099
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    Technical Identifiers
    IUPAC Name
    (1S,2S,3S,4R,5S)-5-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-1-(hydroxymethyl)-6,8-dioxabicyclo[3.2.1]octane-2,3,4-triol;(2S)-5-oxopyrrolidine-2-carshow more
    SMILES
    CCOC1=CC=C(C=C1)CC2=C(C=CC(=C2)C34C(C(C(C(O3)(CO4)CO)O)O)O)Cl.C1CC(=O)NC1C(=O)O
    InChIKey
    YHIUPZFKHZTLSH-LXYIGGQGSA-N
    InChI
    1S/C22H25ClO7.C5H7NO3/c1-2-28-16-6-3-13(4-7-16)9-14-10-15(5-8-17(14)23)22-20(27)18(25)19(26)21(11-24,30-22)12-29-22;7-4-2-1-3(6-4)5(8)9/h3-8,10,18-20,show more
    Synonyms
    ERTUGLIFLOZIN PIDOLATE COMPONENT OF SEGLUROMET | D80789 | (S)-5-oxopyrrolidine-2-carboxylic acid compound with (1S,2S...
  5. Eptapirone
    CAS: 179756-58-2 Formula: C16H23N7O2 Molecular Weight: 345.40
    ◐ .Made to order · 8–12 wks Item #: E412186
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    Technical Identifiers
    IUPAC Name
    4-methyl-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2,4-triazine-3,5-dione
    SMILES
    CN1C(=O)C=NN(C1=O)CCCCN2CCN(CC2)C3=NC=CC=N3
    InChIKey
    NMYAHEULKSYAPP-UHFFFAOYSA-N
    InChI
    1S/C16H23N7O2/c1-20-14(24)13-19-23(16(20)25)8-3-2-7-21-9-11-22(12-10-21)15-17-5-4-6-18-15/h4-6,13H,2-3,7-12H2,1H3
    Synonyms
    4-Methyl-2-(4-(4-(2-pyrimidinyl)-1-piperazinyl)butyl)-as-triazine-3,5(2H,4H)-dione. | AS-74190 | ZB0032 | Eptapirone[...
  6. Eptifibatide Acetate
    CAS: 148031-34-9 Formula: C35H49N11O9S2 Molecular Weight: 832
    Liquid 10mM in Water
    ● In Stock — US warehouse, ships to EU* Item #: E421733
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    IUPAC Name
    2-[20-carbamoyl-12-[4-(diaminomethylideneamino)butyl]-3-(1H-indol-3-ylmethyl)-2,5,8,11,14,22-hexaoxo-17,18-dithia-1,4,7,10,13,21-hexazabicyclo[21.3.0]show more
    SMILES
    C1CC2C(=O)NC(CSSCCC(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)N2C1)CC3=CNC4=CC=CC=C43)CC(=O)O)CCCCN=C(N)N)C(=O)N
    InChIKey
    CZKPOZZJODAYPZ-UHFFFAOYSA-N
    InChI
    1S/C35H49N11O9S2/c36-30(51)25-18-57-56-13-10-27(47)42-22(8-3-4-11-39-35(37)38)31(52)41-17-28(48)43-23(15-29(49)50)32(53)44-24(14-19-16-40-21-7-2-1-6-2show more
    Synonyms
    Mpr-Har-Gly-Asp-Trp-Pro-Cys-NH2
  7. Equisetin
    CAS: 57749-43-6 Formula: C22H31NO4 Molecular Weight: 373.49
    ◐ .Made to order · 8–12 wks Item #: E329522
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    IUPAC Name
    (3E,5S)-3-[[(1S,2R,4aS,6R,8aR)-1,6-dimethyl-2-[(E)-prop-1-enyl]-4a,5,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-hydroxymethylidene]-5-(hydroxymethyl)-1-meshow more
    SMILES
    CC=CC1C=CC2CC(CCC2C1(C)C(=C3C(=O)C(N(C3=O)C)CO)O)C
    InChIKey
    QNQBPPQLRODXET-AIMHRHHOSA-N
    InChI
    1S/C22H31NO4/c1-5-6-15-9-8-14-11-13(2)7-10-16(14)22(15,3)20(26)18-19(25)17(12-24)23(4)21(18)27/h5-6,8-9,13-17,24,26H,7,10-12H2,1-4H3/b6-5+,20-18+/t13-show more
    Synonyms
    V56ZMM5VMZ | Equisetin | HY-N6711 | DTXSID001017630 | QNQBPPQLRODXET-AIMHRHHOSA-N | 2,4-Pyrrolidinedione, 5-(hydroxym...
  8. Equol, Estrogen receptor beta agonist
    CAS: 531-95-3 EC Number: 208-522-2 Formula: C15H14O3 Molecular Weight: 242.27
    Liquid 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: E407986
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    Technical Identifiers
    Synonyms
    2H-1-Benzopyran-7-ol, 3,4-dihydro-3-(4-hydroxyphenyl)-, (3S)-
  9. Erdosteine, Anti-inflammatory, anti-oxidant
    CAS: 84611-23-4 EC Number: 642-172-5 Formula: C8H11NO4S2 Molecular Weight: 249.31
    Liquid 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: E408246
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    Technical Identifiers
    Synonyms
    KW-9144 | 2-​[[2-​oxo-​2-​[(tetrahydro-​2-​oxo-​3-​thienyl)​amino]​ethyl]​thio]​-acetic acid
  10. Erythromycin estolate, Bacterial 70S ribosome inhibitor
    CAS: 3521-62-8 EC Number: 222-532-4 Formula: C52H97NO18S Molecular Weight: 1056.39
    Liquid 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: E423573
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    Technical Identifiers
    IUPAC Name
    [(2S,3R,4S,6R)-4-(dimethylamino)-2-[[(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethylshow more
    SMILES
    CCCCCCCCCCCCOS(=O)(=O)O.CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)OC(=O)CC)(C)O)C)C)O)(C)O
    InChIKey
    AWMFUEJKWXESNL-JZBHMOKNSA-N
    InChI
    1S/C40H71NO14.C12H26O4S/c1-15-27-40(11,48)33(44)22(5)30(43)20(3)18-38(9,47)35(55-37-32(53-28(42)16-2)26(41(12)13)17-21(4)50-37)23(6)31(24(7)36(46)52-2show more
    Synonyms
    ERYTHROMYCIN ESTOLATE (EP MONOGRAPH) | ERYTHROMYCIN, 2'-PROPANOATE, DODECYL SULPHATE (SALT) | Ery-Toxinal dodecylsulf...
  11. Erlotinib (OSI-774), Inhibitor of epidermal growth factor receptor;Inhibitor of OATP2B1
    CAS: 183321-74-6 EC Number: 689-196-2 Formula: C22H23N3O4 Molecular Weight: 393.44
    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 #: E408359
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    Technical Identifiers
    Synonyms
    CP358774, NSC 718781, Tarceva
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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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