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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Ligand families
24,635Navigate 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
2,814PROTAC 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.
By Signaling Pathways
102,621Explore 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.
By Target (DTO)
19,694Find 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.
By Disease (DOID)
8,779Shop 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.
Products
- LvguidinganCAS: 82351-05-1 Formula: C13H15Cl2NO Molecular Weight: 272.17● In Stock — US warehouse, ships to EU* Item #: L412255View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (E)-N-butan-2-yl-3-(3,4-dichlorophenyl)prop-2-enamide
- SMILES
- CCC(C)NC(=O)C=CC1=CC(=C(C=C1)Cl)Cl
- InChIKey
- WMHSFCNWWYFBSS-FNORWQNLSA-N
- InChI
- 1S/C13H15Cl2NO/c1-3-9(2)16-13(17)7-5-10-4-6-11(14)12(15)8-10/h4-9H,3H2,1-2H3,(H,16,17)/b7-5+
- Synonyms
- AKOS016196928 | HY-100377 | (E)-N-butan-2-yl-3-(3,4-dichlorophenyl)prop-2-enamide | Anticonvulsant 7903 | N-(butan-2-...
- LvguidinganCAS: 82351-05-1 Formula: C13H15Cl2NO Molecular Weight: 272.1710mM in DMSO● In Stock — US warehouse, ships to EU* Item #: L426127View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (E)-N-butan-2-yl-3-(3,4-dichlorophenyl)prop-2-enamide
- SMILES
- CCC(C)NC(=O)C=CC1=CC(=C(C=C1)Cl)Cl
- InChIKey
- WMHSFCNWWYFBSS-FNORWQNLSA-N
- InChI
- 1S/C13H15Cl2NO/c1-3-9(2)16-13(17)7-5-10-4-6-11(14)12(15)8-10/h4-9H,3H2,1-2H3,(H,16,17)/b7-5+
- Synonyms
- Lvguidingan|82351-05-1|Anticonvulsant 7903|(E)-N-butan-2-yl-3-(3,4-dichlorophenyl)prop-2-enamide|2-Propenamide, 3-(3,...
- LycoramineCAS: 21133-52-8 Formula: C17H23NO3 Molecular Weight: 289.37● In Stock — US warehouse, ships to EU* Item #: L353976View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (1R,12S,14S)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9-trien-14-ol
- SMILES
- CN1CCC23CCC(CC2OC4=C(C=CC(=C34)C1)OC)O
- InChIKey
- GJRMHIXYLGOZSE-JDFRZJQESA-N
- InChI
- 1S/C17H23NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-4,12,14,19H,5-10H2,1-2H3/t12-,14-,17-/m0/s1
- Synonyms
- (4AS,6S,8AR)-3-METHOXY-11-METHYL-5,6,7,8,9,10,11,12-OCTAHYDRO-4AH-(1)BENZOFURO(3A,3,2-EF)(2)BENZAZEPIN-6-OL | GALANTA...
- LycorineCAS: 476-28-8 Formula: C16H17NO4 Molecular Weight: 287.3110mM in DMSO● In Stock — US warehouse, ships to EU* Item #: L424142View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (1S,17S,18S,19S)-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9,15-tetraene-17,18-diol
- SMILES
- C1CN2CC3=CC4=C(C=C3C5C2C1=CC(C5O)O)OCO4
- InChIKey
- XGVJWXAYKUHDOO-DANNLKNASA-N
- InChI
- 1S/C16H17NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h3-5,11,14-16,18-19H,1-2,6-7H2/t11-,14-,15+,16+/m0/s1
- Synonyms
- Bunt-no-more | Bio2_000502 | EINECS 207-503-6 | Ethyl o-hydroxybenzoate | U-17312E | KBio2_000022 | HMS1791B04 | KBio...
- LycorineCAS: 476-28-8 Formula: C16H17NO4 Molecular Weight: 287.31● In Stock — US warehouse, ships to EU* Item #: L413074View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (1S,17S,18S,19S)-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9,15-tetraene-17,18-diol
- SMILES
- C1CN2CC3=CC4=C(C=C3C5C2C1=CC(C5O)O)OCO4
- InChIKey
- XGVJWXAYKUHDOO-DANNLKNASA-N
- InChI
- 1S/C16H17NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h3-5,11,14-16,18-19H,1-2,6-7H2/t11-,14-,15+,16+/m0/s1
- Synonyms
- Bunt-no-more | Bio2_000502 | EINECS 207-503-6 | Ethyl o-hydroxybenzoate | U-17312E | KBio2_000022 | HMS1791B04 | KBio...
- Lynestrenol● In Stock — US warehouse, ships to EU* Item #: L353764View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (8R,9S,10R,13S,14S,17R)-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol
- SMILES
- CC12CCC3C(C1CCC2(C#C)O)CCC4=CCCCC34
- InChIKey
- YNVGQYHLRCDXFQ-XGXHKTLJSA-N
- InChI
- 1S/C20H28O/c1-3-20(21)13-11-18-17-9-8-14-6-4-5-7-15(14)16(17)10-12-19(18,20)2/h1,6,15-18,21H,4-5,7-13H2,2H3/t15-,16+,17+,18-,19-,20-/m0/s1
- Synonyms
- Lynestrenolum [INN-Latin] | NCGC00179676-03 | SCHEMBL37816 | Exlutona | BSPBio_000050 | 19-Nor-17-alpha-pregn-4-en-20...
- Lynestrenol10mM in DMSO◐ .Made to order · 8–12 wks Item #: L424528View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (8R,9S,10R,13S,14S,17R)-17-ethynyl-13-methyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol
- SMILES
- CC12CCC3C(C1CCC2(C#C)O)CCC4=CCCCC34
- InChIKey
- YNVGQYHLRCDXFQ-XGXHKTLJSA-N
- InChI
- 1S/C20H28O/c1-3-20(21)13-11-18-17-9-8-14-6-4-5-7-15(14)16(17)10-12-19(18,20)2/h1,6,15-18,21H,4-5,7-13H2,2H3/t15-,16+,17+,18-,19-,20-/m0/s1
- Synonyms
- LYNESTRENOL|52-76-6|Linestrenol|Lynoestrenol|Ethinylestrenol|Ethynylestrenol|Orgametril|Orgametrol|Exluton|Endometril...
- Luteolin, Agonist of TAS2R14;Agonist of TAS2R39Moligand™ ? 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 #: L409168View ProductPricing & Pack Sizes
Technical Identifiers
- Synonyms
- Luteoline, Luteolol, Digitoflavone | 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-
- MAT2A inhibitor 2CAS: 13299-99-5 Formula: C18H24ClN3O3 Molecular Weight: 365.9◐ .Made to order · 8–12 wks Item #: M413530View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 6-(3-methoxyphenyl)-4-methyl-2-(2-morpholin-4-ylethyl)pyridazin-3-one;hydrochloride
- SMILES
- CC1=CC(=NN(C1=O)CCN2CCOCC2)C3=CC(=CC=C3)OC.Cl
- InChIKey
- REOUTEBTFSILJY-UHFFFAOYSA-N
- InChI
- 1S/C18H23N3O3.ClH/c1-14-12-17(15-4-3-5-16(13-15)23-2)19-21(18(14)22)7-6-20-8-10-24-11-9-20;/h3-5,12-13H,6-11H2,1-2H3;1H
- Synonyms
- 3(2H)-Pyridazinone, 6-(m-methoxyphenyl)-4-methyl-2-(2-morpholinoethyl)-, hydrochloride | 6-(3-Methoxyphenyl)-4-methyl...
- MAZ51Moligand™ ? 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 #: M338455View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 3-[[4-(dimethylamino)naphthalen-1-yl]methylidene]-1H-indol-2-one
- SMILES
- CN(C)C1=CC=C(C2=CC=CC=C21)C=C3C4=CC=CC=C4NC3=O
- InChIKey
- VFCXONOPGCDDBQ-UHFFFAOYSA-N
- InChI
- 1S/C21H18N2O/c1-23(2)20-12-11-14(15-7-3-4-9-17(15)20)13-18-16-8-5-6-10-19(16)22-21(18)24/h3-13H,1-2H3,(H,22,24)
- Synonyms
- 3-(4-Dimethylaminonaphthalen-1-ylmethylene)-1,3-dihydroindol-2-one | BCP31595 | SCHEMBL3374614 | VFCXONOPGCDDBQ-UHFFF...
- MCP110CAS: 521310-51-0 Formula: C33H36N2O3 Molecular Weight: 508.6510mM in DMSO● In Stock — US warehouse, ships to EU* Item #: M424465View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-5-phenyl-N-(2-pyridin-2-ylethyl)pentanamide
- SMILES
- COC1=C(C=CC(=C1)CN(CCC2=CC=CC=N2)C(=O)CCCCC3=CC=CC=C3)OCC4=CC=CC=C4
- InChIKey
- JWLZIHLAMJDONF-UHFFFAOYSA-N
- InChI
- show more
- Synonyms
- Benzenepentanamide,N-[[3-methoxy-4-(phenylmethoxy)phenyl]methyl]-N-[2-(2-pyridinyl)ethyl]-
- MDL 72222Solid ≥99%● In Stock — US warehouse, ships to EU* Item #: M275903View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- [(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3,5-dichlorobenzoate
- SMILES
- CN1C2CCC1CC(C2)OC(=O)C3=CC(=CC(=C3)Cl)Cl
- InChIKey
- MNJNPLVXBISNSX-PBWFPOADSA-N
- InChI
- 1S/C15H17Cl2NO2/c1-18-12-2-3-13(18)8-14(7-12)20-15(19)9-4-10(16)6-11(17)5-9/h4-6,12-14H,2-3,7-8H2,1H3/t12-,13+,14?
- Synonyms
- Bemesetron (USAN/INN) | BEMESETRON [USAN] | Tocris-0640 | Tox21_110293_1 | NCGC00186619-01 | CAS-40796-97-2 | BEMESET...
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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.