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 (where available)—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. Peptone from soybean
    CAS: 91079-46-8 EC Number: 293-434-7
    BioReagent ? BioReagent grade — tested suitable for life-science and molecular-biology use. Use for cell culture, assays, and biochemical work needing biological compatibility. CellNourish™ Basic ? CellNourish™ Basic — cost-efficient culture media for routine cell growth. Use for standard maintenance and expansion where premium media aren't needed. N≥9%
    ● In Stock — US warehouse, ships to EU* Item #: P304956
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  2. Pentaerythritol glycidyl ether
    CAS: 3126-63-4 PubChem CID: 76579 Formula: C17H28O8 Molecular Weight: 360.40
    Viscosity: ~600 cPs
    ● In Stock — US warehouse, ships to EU* Item #: P303412
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    IUPAC Name
    2-[[3-(oxiran-2-ylmethoxy)-2,2-bis(oxiran-2-ylmethoxymethyl)propoxy]methyl]oxirane
    SMILES
    C1C(O1)COCC(COCC2CO2)(COCC3CO3)COCC4CO4
    InChIKey
    PLDLPVSQYMQDBL-UHFFFAOYSA-N
    InChI
    1S/C17H28O8/c1(13-5-22-13)18-9-17(10-19-2-14-6-23-14,11-20-3-15-7-24-15)12-21-4-16-8-25-16/h13-16H,1-12H2
    Synonyms
    Pentaerythritol glycidyl ether|3126-63-4|Pentaerythritol tetraglycidyl ether|2-[[3-(oxiran-2-ylmethoxy)-2,2-bis(oxira...
  3. Limaprost
    CAS: 74397-12-9 PubChem CID: 6438378 Formula: C22H36O5 Molecular Weight: 380.52
    ● In Stock — US warehouse, ships to EU* Item #: L134841
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    (E)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S,5S)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopentyl]hept-2-enoic acid
    SMILES
    CCCCC(C)CC(C=CC1C(CC(=O)C1CCCCC=CC(=O)O)O)O
    InChIKey
    OJZYRQPMEIEQFC-UAWLTFRCSA-N
    InChI
    1S/C22H36O5/c1-3-4-9-16(2)14-17(23)12-13-19-18(20(24)15-21(19)25)10-7-5-6-8-11-22(26)27/h8,11-13,16-19,21,23,25H,3-7,9-10,14-15H2,1-2H3,(H,26,27)/b11-show more
    Synonyms
    CHEBI:135594 | DTXSID60942755 | (E)-7-((1R,3R)-3-hydroxy-2-((3S,5S,E)-3-hydroxy-5-methylnon-1-en-1-yl)-5-oxocyclopent...
  4. Limonin glucoside
    CAS: 123564-61-4 PubChem CID: 24820753 Formula: C32H42O14 Molecular Weight: 650.67
    ● In Stock — US warehouse, ships to EU* Item #: L275342
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    (1R,2R,2'S,5S,6R,7R,10R,13S)-5-[(S)-furan-3-yl-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-5,7,11,11-tetramethyl-8,15-dioshow more
    SMILES
    CC1(C2CC(=O)C3(C(C24COC(=O)CC4O1)CCC(C35C(O5)C(=O)O)(C)C(C6=COC=C6)OC7C(C(C(C(O7)CO)O)O)O)C)C
    InChIKey
    FYIKIBQJAJRKQM-WNCNYDOCSA-N
    InChI
    1S/C32H42O14/c1-28(2)17-9-18(34)30(4)16(31(17)13-42-20(35)10-19(31)45-28)5-7-29(3,32(30)25(46-32)26(39)40)24(14-6-8-41-12-14)44-27-23(38)22(37)21(36)1show more
    Synonyms
    LIMONOIC ACID, 17-O-.BETA.-D-GLUCOPYRANOSYL-, .DELTA.-LACTONE | AKOS040748750 | C06740 | limonin 17-beta-D-glucoside ...
  5. Lidocaine Hydrochloride Monohydrate, Sodium channel alpha subunit blocker
    CAS: 6108-05-0 Formula: C14H22N2O · HCl · H2O Molecular Weight: 288.81
    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 #: L137296
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    2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide;hydrate;hydrochloride
    SMILES
    CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.O.Cl
    InChIKey
    YECIFGHRMFEPJK-UHFFFAOYSA-N
    InChI
    1S/C14H22N2O.ClH.H2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4;;/h7-9H,5-6,10H2,1-4H3,(H,15,17);1H;1H2
    Synonyms
    2',6'-ACETOXYLIDIDE, 2-(DIETHYLAMINO)-, HYDROCHLORIDE, HYDRATE | LIDOCAINE HYDROCHLORIDE [USP-RS] | 2-(Diethylamino)-...
  6. WYE-125132 (WYE-132)
    CAS: 1144068-46-1 PubChem CID: 25260757 Formula: C27H33N7O4 Molecular Weight: 519.61
    ● In Stock — US warehouse, ships to EU* Item #: W128041
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    IUPAC Name
    1-[4-[1-(1,4-dioxaspiro[4.5]decan-8-yl)-4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyrazolo[3,4-d]pyrimidin-6-yl]phenyl]-3-methylurea
    SMILES
    CNC(=O)NC1=CC=C(C=C1)C2=NC3=C(C=NN3C4CCC5(CC4)OCCO5)C(=N2)N6CC7CCC(C6)O7
    InChIKey
    QLHHRYZMBGPBJG-UHFFFAOYSA-N
    InChI
    1S/C27H33N7O4/c1-28-26(35)30-18-4-2-17(3-5-18)23-31-24(33-15-20-6-7-21(16-33)38-20)22-14-29-34(25(22)32-23)19-8-10-27(11-9-19)36-12-13-37-27/h2-5,14,1show more
    Synonyms
    EX-A2183 | WYE125132 | WYE-125132 | 3-(4-methoxyphenyl)-1-methyl-5-p-tolyl-1H-pyrazole | NCGC00346635-01 | Q27163233 ...
  7. Withanone
    CAS: 27570-38-3 Formula: C28H38O6 Molecular Weight: 470.60
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥95%
    ◐ .Made to order · 8–12 wks Item #: W350938
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    IUPAC Name
    (1S,2S,4S,5R,10R,11S,14S,15S,18S)-15-[(1R)-1-[(2R)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-5,15-dihydroxy-10,14-dimethyl-3-oxapentacyclo[9.7.0show more
    SMILES
    CC1=C(C(=O)OC(C1)C(C)C2(CCC3C2(CCC4C3C5C(O5)C6(C4(C(=O)C=CC6)C)O)C)O)C
    InChIKey
    FAZIYUIDUNHZRG-PCTWTJKKSA-N
    InChI
    1S/C28H38O6/c1-14-13-19(33-24(30)15(14)2)16(3)27(31)12-9-17-21-18(8-11-25(17,27)4)26(5)20(29)7-6-10-28(26,32)23-22(21)34-23/h6-7,16-19,21-23,31-32H,8-show more
    Synonyms
    AKOS040762509 | DTXSID40950237 | 15-[1-(4,5-Dimethyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-5,15-dihydroxy-10,14-dimethyl...
  8. XAC
    CAS: 1962928-23-9 PubChem CID: 121513846 Formula: C21H28N6O4·2HCl Molecular Weight: 501.41
    ● In Stock — US warehouse, ships to EU* Item #: X287356
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    IUPAC Name
    N-(2-aminoethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenoxy]acetamide;dihydrochloride
    SMILES
    CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC=C(C=C3)OCC(=O)NCCN.Cl.Cl
    InChIKey
    KGNTWECSNGWFKE-UHFFFAOYSA-N
    InChI
    1S/C21H28N6O4.2ClH/c1-3-11-26-19-17(20(29)27(12-4-2)21(26)30)24-18(25-19)14-5-7-15(8-6-14)31-13-16(28)23-10-9-22;;/h5-8H,3-4,9-13,22H2,1-2H3,(H,23,28)show more
    Synonyms
    Xanthine amine congener | N-(2-Aminoethyl)-2-[4-(2,3,6,7-tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)phenoxy]-ace...
  9. WYE-687
    CAS: 1062161-90-3 PubChem CID: 25229450 Formula: C28H32N8O3 Molecular Weight: 528.61
    ● In Stock — US warehouse, ships to EU* Item #: W126399
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    IUPAC Name
    methyl N-[4-[4-morpholin-4-yl-1-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[3,4-d]pyrimidin-6-yl]phenyl]carbamate
    SMILES
    COC(=O)NC1=CC=C(C=C1)C2=NC3=C(C=NN3C4CCN(CC4)CC5=CN=CC=C5)C(=N2)N6CCOCC6
    InChIKey
    VDOCQQKGPJENHJ-UHFFFAOYSA-N
    InChI
    1S/C28H32N8O3/c1-38-28(37)31-22-6-4-21(5-7-22)25-32-26(35-13-15-39-16-14-35)24-18-30-36(27(24)33-25)23-8-11-34(12-9-23)19-20-3-2-10-29-17-20/h2-7,10,1show more
    Synonyms
    WYE687 | WYE-687 | pyrazolo pyrimidine, 9 | DTXSID40649396 | AKOS027307847 | EX-A7650 | A919515 | SB19262 | WYE 687;W...
  10. WZ8040
    CAS: 1214265-57-2 PubChem CID: 44607531 Formula: C24H25ClN6OS Molecular Weight: 481.02
    ● In Stock — US warehouse, ships to EU* Item #: W126471
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    IUPAC Name
    N-[3-[5-chloro-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]sulfanylphenyl]prop-2-enamide
    SMILES
    CN1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C(C(=N3)SC4=CC=CC(=C4)NC(=O)C=C)Cl
    InChIKey
    KIISCIGBPUVZBF-UHFFFAOYSA-N
    InChI
    1S/C24H25ClN6OS/c1-3-22(32)27-18-5-4-6-20(15-18)33-23-21(25)16-26-24(29-23)28-17-7-9-19(10-8-17)31-13-11-30(2)12-14-31/h3-10,15-16H,1,11-14H2,2H3,(H,2show more
    Synonyms
    AKOS027276489 | EX-A4023 | SW219395-1 | W-108455 | FT-0728045 | WZ8040 | WZ-8040 | F82898 | AC-32056 | CCG-269557 | S...
  11. WZB 117
    CAS: 1223397-11-2 PubChem CID: 46830365 Formula: C20H13FO6 Molecular Weight: 368.31
    ● In Stock — US warehouse, ships to EU* Item #: W287116
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    IUPAC Name
    [3-fluoro-2-(3-hydroxybenzoyl)oxyphenyl] 3-hydroxybenzoate
    SMILES
    C1=CC(=CC(=C1)O)C(=O)OC2=C(C(=CC=C2)F)OC(=O)C3=CC(=CC=C3)O
    InChIKey
    FRSWCCBXIHFKKY-UHFFFAOYSA-N
    InChI
    1S/C20H13FO6/c21-16-8-3-9-17(26-19(24)12-4-1-6-14(22)10-12)18(16)27-20(25)13-5-2-7-15(23)11-13/h1-11,22-23H
    Synonyms
    EX-A1492 | BCP24665 | BW167833 | [3-fluoro-2-(3-hydroxybenzoyl)oxyphenyl] 3-hydroxybenzoate | AC-32898 | 3-FLUORO-2-(...
  12. XE-991 dihydrochloride
    CAS: 122955-13-9 PubChem CID: 45073462 Formula: C26H20N2O.2HCl Molecular Weight: 449.4
    ● In Stock — US warehouse, ships to EU* Item #: X275160
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    IUPAC Name
    10,10-bis(pyridin-4-ylmethyl)anthracen-9-one;dihydrochloride
    SMILES
    C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2(CC4=CC=NC=C4)CC5=CC=NC=C5.Cl.Cl
    InChIKey
    WOGWMARIFDNZON-UHFFFAOYSA-N
    InChI
    1S/C26H20N2O.2ClH/c29-25-21-5-1-3-7-23(21)26(17-19-9-13-27-14-10-19,18-20-11-15-28-16-12-20)24-8-4-2-6-22(24)25;;/h1-16H,17-18H2;2*1H
    Synonyms
    SR-01000597960-1 | XE 991 dihydrochloride | s2967 | XE991Dihydrochloride | 10,10-bis(pyridin-4-ylmethyl)anthracen-9(1...
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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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