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).
Targets & Pathways
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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
Ligand families
24,638Navigate 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 for designing and evaluating ADC constructs.
PROTAC
2,815PROTAC and targeted protein degradation tools for discovery research. Browse degrader-related ligands, linkers, and building blocks to assemble or screen PROTAC designs, with clear identifiers for efficient selection.
By Signaling Pathways
102,614Explore 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
- Diclofenac, Cyclooxygenase inhibitorMoligand™ ? 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 Item #: D421816View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2-[2-(2,6-dichloroanilino)phenyl]acetic acid
- SMILES
- C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)Cl
- InChIKey
- DCOPUUMXTXDBNB-UHFFFAOYSA-N
- InChI
- 1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)
- Synonyms
- diclofenac|Diclofenac acid|15307-86-5|dichlofenac|Diclofenacum|Diclophenac|Diclofenaco|ProSorb-D|2-(2-((2,6-Dichlorop...
- DidanosineMoligand™ ? 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 Item #: D408580View ProductPricing & Pack Sizes
Technical Identifiers
- Synonyms
- 2',3'-dideoxy-inosine
- Didestriazole anastrozole dimer impurityCAS: 918312-71-7 Formula: C26H29N3 Molecular Weight: 383.53● In Stock — US Item #: D349682View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2,3-bis[3-(2-cyanopropan-2-yl)-5-methylphenyl]-2-methylpropanenitrile
- SMILES
- CC1=CC(=CC(=C1)C(C)(C)C#N)CC(C)(C#N)C2=CC(=CC(=C2)C(C)(C)C#N)C
- InChIKey
- DSWIROKRYFYWHD-UHFFFAOYSA-N
- InChI
- 1S/C26H29N3/c1-18-8-20(12-21(9-18)24(3,4)15-27)14-26(7,17-29)23-11-19(2)10-22(13-23)25(5,6)16-28/h8-13H,14H2,1-7H3
- Synonyms
- 2,2'-[(2-Cyanopropane-1,2-diyl)bis(5-methyl-3,1-phenylene)]bis(2-methylpropanenitrile) | DTXSID80581004 | 2,3-bis[3-(...
- Diethyl cromoglycateCAS: 16150-45-1 Formula: C27H24O11 Molecular Weight: 524.48● In Stock — US Item #: D352722View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- ethyl 5-[3-(2-ethoxycarbonyl-4-oxochromen-5-yl)oxy-2-hydroxypropoxy]-4-oxochromene-2-carboxylate
- SMILES
- CCOC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OCC(COC3=CC=CC4=C3C(=O)C=C(O4)C(=O)OCC)O
- InChIKey
- KRBBSLDXYDBFEC-UHFFFAOYSA-N
- InChI
- show more
- Synonyms
- 4H-1-BENZOPYRAN-2-CARBOXYLIC ACID, 5,5'-((2-HYDROXY-1,3-PROPANEDIYL)BIS(OXY))BIS(4-OXO-, 2,2'-DIETHYL ESTER | 1,3-Bis...
- Diethyl hydrogen phosphateCAS: 598-02-7 Formula: C4H11O4P Molecular Weight: 154.110mM in DMSO● In Stock — US Item #: D424974View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- diethyl hydrogen phosphate
- SMILES
- CCOP(=O)(O)OCC
- InChIKey
- UCQFCFPECQILOL-UHFFFAOYSA-N
- InChI
- 1S/C4H11O4P/c1-3-7-9(5,6)8-4-2/h3-4H2,1-2H3,(H,5,6)
- Synonyms
- BRN 1704113 | diethylphosphate | diethoxyphosphinic acid | NSC-289395 | diethyl hydrogen phosphate | DPF | O,O-Diethy...
- Diethyl isoamylmalonateCAS: 5398-08-3 Formula: C12H22O4 Molecular Weight: 230.3● In Stock — US Item #: D331119View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- diethyl 2-(3-methylbutyl)propanedioate
- SMILES
- CCOC(=O)C(CCC(C)C)C(=O)OCC
- InChIKey
- MPJCIHOJXMCSIM-UHFFFAOYSA-N
- InChI
- 1S/C12H22O4/c1-5-15-11(13)10(8-7-9(3)4)12(14)16-6-2/h9-10H,5-8H2,1-4H3
- Synonyms
- diethyl 2-(3-methylbutyl)propanedioate | Malonic acid, isopentyl-, diethyl ester | 2-(3-methylbutyl)propanedioic acid...
- Diethyl isobutyroylmalonateCAS: 21633-78-3 Formula: C11H18O5 Molecular Weight: 230.26● In Stock — US Item #: D351838View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- diethyl 2-(2-methylpropanoyl)propanedioate
- SMILES
- CCOC(=O)C(C(=O)C(C)C)C(=O)OCC
- InChIKey
- CBFJLYQEACAOLC-UHFFFAOYSA-N
- InChI
- 1S/C11H18O5/c1-5-15-10(13)8(9(12)7(3)4)11(14)16-6-2/h7-8H,5-6H2,1-4H3
- Diethyl 2-Acetamido-2-[2-(4-octylphenylethyl)malonate● In Stock — US Item #: D333137View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- diethyl 2-acetamido-2-[2-(4-octylphenyl)ethyl]propanedioate
- SMILES
- CCCCCCCCC1=CC=C(C=C1)CCC(C(=O)OCC)(C(=O)OCC)NC(=O)C
- InChIKey
- RYOKCHIAMHPMLV-UHFFFAOYSA-N
- InChI
- 1S/C25H39NO5/c1-5-8-9-10-11-12-13-21-14-16-22(17-15-21)18-19-25(26-20(4)27,23(28)30-6-2)24(29)31-7-3/h14-17H,5-13,18-19H2,1-4H3,(H,26,27)
- Synonyms
- Diethyl 2-(Acetamido)-2-(2-(4-octylphenyl)ethyl)propanedioate | AKOS016003754 | EX-A1405 | diethyl 2-acetamido-2-(4-o...
- Diethyl aminomethylenemalonateCAS: 6296-99-7 Formula: C8H13NO4 Molecular Weight: 187.2● In Stock — US Item #: D352148View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- diethyl 2-(aminomethylidene)propanedioate
- SMILES
- CCOC(=O)C(=CN)C(=O)OCC
- InChIKey
- WDTWMEZMHUEZKH-UHFFFAOYSA-N
- InChI
- 1S/C8H13NO4/c1-3-12-7(10)6(5-9)8(11)13-4-2/h5H,3-4,9H2,1-2H3
- Synonyms
- J-520276 | BCP33376 | MFCD01075695 | DIETHYL AMINOMETHYLENEMALONATE | diethyl amino-methylenemalonate | diethyl 2-(am...
- Diethyl 5-hydantoylphosphonateCAS: 95378-36-2 Formula: C7H13N2O5P Molecular Weight: 236.16● In Stock — US Item #: D351591View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 5-diethoxyphosphorylimidazolidine-2,4-dione
- SMILES
- CCOP(=O)(C1C(=O)NC(=O)N1)OCC
- InChIKey
- PNQYQNIOVAYJJG-UHFFFAOYSA-N
- InChI
- 1S/C7H13N2O5P/c1-3-13-15(12,14-4-2)6-5(10)8-7(11)9-6/h6H,3-4H2,1-2H3,(H2,8,9,10,11)
- Synonyms
- STR08723 | AKOS024371034 | DTXSID00393222 | PNQYQNIOVAYJJG-UHFFFAOYSA-N | diethyl 2,4-dioxoimidazoline-5-phosphonate ...
- Diflunisal10mM in DMSO● In Stock — US Item #: D422706View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 5-(2,4-difluorophenyl)-2-hydroxybenzoic acid
- SMILES
- C1=CC(=C(C=C1C2=C(C=C(C=C2)F)F)C(=O)O)O
- InChIKey
- HUPFGZXOMWLGNK-UHFFFAOYSA-N
- InChI
- 1S/C13H8F2O3/c14-8-2-3-9(11(15)6-8)7-1-4-12(16)10(5-7)13(17)18/h1-6,16H,(H,17,18)
- Synonyms
- diflunisal|22494-42-4|Dolobid|Dolobis|Flovacil|Fluniget|Fluodonil|Adomal|Flustar|5-(2,4-Difluorophenyl)salicylic acid...
- Diethylene Glycol MonolaurateCAS: 141-20-8 Formula: C16H32O4 Molecular Weight: 288.42● In Stock — US Item #: D350621View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2-(2-hydroxyethoxy)ethyl dodecanoate
- SMILES
- CCCCCCCCCCCC(=O)OCCOCCO
- InChIKey
- WGIMXKDCVCTHGW-UHFFFAOYSA-N
- InChI
- 1S/C16H32O4/c1-2-3-4-5-6-7-8-9-10-11-16(18)20-15-14-19-13-12-17/h17H,2-15H2,1H3
- Synonyms
- UNII-XBL949IG2F | Diethylene glycol laurate | Ethanol, 2-(2-hydroxyethoxy)-, laurate | Glaurin | NSC 3868 | 2,2'-Dihy...
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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.