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).
By Target / Pathway / Disease
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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
24,635Navigate 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
- CGRP(hu,Mod Asp3 to Pra)，TFA saltFormula: C164H266N50O48S2·xCF3COOH Molecular Weight: 3770.33 (free base)● In Stock — US warehouse, ships to EU* Item #: C276414View ProductPricing & Pack Sizes
Technical Identifiers
- CGS 12066B dimaleate◐ .Made to order · 8–12 wks Item #: C286871View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (Z)-but-2-enedioic acid;4-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline
- SMILES
- CN1CCN(CC1)C2=NC3=C(C=CC(=C3)C(F)(F)F)N4C2=CC=C4.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O
- InChIKey
- HTEVMLYDEWVIQE-SPIKMXEPSA-N
- InChI
- show more
- Synonyms
- 4-(4-Methyl-piperazin-1-yl)-7-trifluoromethyl-pyrrolo[1,2-a]quinoxaline dimaleate | (Z)-but-2-enedioic acid;4-(4-meth...
- CGS 21680 hydrochlorideCAS: 124431-80-7 Formula: C₂₃H₂₉N₇O₆.HCl Molecular Weight: 535.99Solid ≥98%(HPLC)● In Stock — US warehouse, ships to EU* Item #: C288822View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 3-[4-[2-[[6-amino-9-[(2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purin-2-yl]amino]ethyl]phenyl]propanoic acid;hydrochloride
- SMILES
- CCNC(=O)C1C(C(C(O1)N2C=NC3=C(N=C(N=C32)NCCC4=CC=C(C=C4)CCC(=O)O)N)O)O.Cl
- InChIKey
- QPHVMNOEKKJYJO-MJWSIIAUSA-N
- InChI
- show more
- Synonyms
- MLS001056776 | 3-(4-(2-(6-amino-9-((2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxytetrahydrofuran-2-yl)-9H-purin-2-yla...
- CGS 9343B◐ .Made to order · 8–12 wks Item #: C286720View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (Z)-but-2-enedioic acid;3-[1-[(4-methyl-6H-pyrrolo[1,2-a][4,1]benzoxazepin-4-yl)methyl]piperidin-4-yl]-1H-benzimidazol-2-one
- SMILES
- CC1(C2=CC=CN2C3=CC=CC=C3CO1)CN4CCC(CC4)N5C6=CC=CC=C6NC5=O.C(=CC(=O)O)C(=O)O
- InChIKey
- NGODOSILXOFQPH-BTJKTKAUSA-N
- InChI
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- Synonyms
- KW 5617 | BRN 0514779 | Cgs 9343B | Zaldaride maleate | AKOS024457009 | DTXSID2059190 | 1,3-DIHYDRO-1-(1-((4-METHYL-4...
- CH-223191Liquid 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◐ .Made to order · 8–12 wks Item #: C408298View ProductPricing & Pack Sizes
Technical Identifiers
- Synonyms
- 2-methyl-N-[2-methyl-4-[(2-methylphenyl)diazenyl]phenyl]pyrazole-3-carboxamide
- CH-223191Moligand™ ? 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 #: C303374View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2-methyl-N-[2-methyl-4-[(2-methylphenyl)diazenyl]phenyl]pyrazole-3-carboxamide
- SMILES
- CC1=CC=CC=C1N=NC2=CC(=C(C=C2)NC(=O)C3=CC=NN3C)C
- InChIKey
- LKTNEXPODAWWFM-UHFFFAOYSA-N
- InChI
- 1S/C19H19N5O/c1-13-6-4-5-7-17(13)23-22-15-8-9-16(14(2)12-15)21-19(25)18-10-11-20-24(18)3/h4-12H,1-3H3,(H,21,25)
- Synonyms
- Q27280162 | CBDivE_007629 | EX-A771 | 1H-Pyrazole-5-carboxamide, 1-methyl-N-(2-methyl-4-(2-(2-methylphenyl)diazenyl)p...
- CH5132799, PI3-kinase class I inhibitorCAS: 1007207-67-1 Formula: C15H19N7O3S Molecular Weight: 377.42Moligand™ ? 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 #: C408435View ProductPricing & Pack Sizes
Technical Identifiers
- Synonyms
- 5-(7-(methylsulfonyl)-2-morpholino-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrimidin-2-amine
- CH5138303CAS: 959763-06-5 Formula: C19 H18Cl N5 O2 S Molecular Weight: 415.910mM in DMSO◐ .Made to order · 8–12 wks Item #: C427155View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 4-[[4-amino-6-(7-chloro-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-8-yl)-1,3,5-triazin-2-yl]sulfanyl]butanamide
- SMILES
- C1C2=C3C(=CC(=C(C3=CC=C2)C4=NC(=NC(=N4)SCCCC(=O)N)N)Cl)CO1
- InChIKey
- VIGHQZSTZWNWFA-UHFFFAOYSA-N
- InChI
- show more
- Synonyms
- Butanamide,4-[[4-amino-6-(5-chloro-1H,3H-naphtho[1,8-cd]pyran-6-yl)-1,3,5-triazin-2-yl]thio]-
- CH5138303CAS: 959763-06-5 Formula: C19 H18Cl N5 O2 S Molecular Weight: 415.9● In Stock — US warehouse, ships to EU* Item #: C413744View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 4-[[4-amino-6-(7-chloro-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-8-yl)-1,3,5-triazin-2-yl]sulfanyl]butanamide
- SMILES
- C1C2=C3C(=CC(=C(C3=CC=C2)C4=NC(=NC(=N4)SCCCC(=O)N)N)Cl)CO1
- InChIKey
- VIGHQZSTZWNWFA-UHFFFAOYSA-N
- InChI
- show more
- Synonyms
- Butanamide,4-[[4-amino-6-(5-chloro-1H,3H-naphtho[1,8-cd]pyran-6-yl)-1,3,5-triazin-2-yl]thio]-
- CH5183284 (Debio-1347), Fibroblast growth factor receptor 1 inhibitorCAS: 1265229-25-1 Formula: C20H16N6O Molecular Weight: 356.38Moligand™ ? 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 #: C421108View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- [5-amino-1-(2-methyl-3H-benzimidazol-5-yl)pyrazol-4-yl]-(1H-indol-2-yl)methanone
- SMILES
- CC1=NC2=C(N1)C=C(C=C2)N3C(=C(C=N3)C(=O)C4=CC5=CC=CC=C5N4)N
- InChIKey
- BEMNJULZEQTDJY-UHFFFAOYSA-N
- InChI
- 1S/C20H16N6O/c1-11-23-16-7-6-13(9-17(16)24-11)26-20(21)14(10-22-26)19(27)18-8-12-4-2-3-5-15(12)25-18/h2-10,25H,21H2,1H3,(H,23,24)
- Synonyms
- (5-amino-1-(2-methyl-3H-benzo[d]imidazol-5-yl)-1H-pyrazol-4-yl)(1H-indol-2-yl)methanone | CH5183284; Debio-1347 | GTP...
- (1E)-CFI-400437 dihydrochloride◐ .Made to order · 8–12 wks Item #: C412347View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 5-methoxy-3-[[3-[(E)-2-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]ethenyl]indazol-6-ylidene]methyl]-1H-indol-2-ol;dihydrochloride
- SMILES
- CN1CCN(CC1)C2=NC=C(C=C2)C=CC3=C4C=CC(=CC5=C(NC6=C5C=C(C=C6)OC)O)C=C4N=N3.Cl.Cl
- InChIKey
- NYCYUHRNBLSJAP-XPDSEMQYSA-N
- InChI
- show more
- Synonyms
- (1E)-CFI-400437 dihydrochloride
- CH7057288, Inhibitor of neurotrophic receptor tyrosine kinase 1;Inhibitor of neurotrophic receptor tyrosine kinase 2;Inhibitor of neurotrophic receptor tyrosine kinase 3CAS: 2095616-82-1 Formula: C32H31N3O5S Molecular Weight: 569.67Moligand™ ? 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 #: C422540View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- N-tert-butyl-2-[2-[8-(methanesulfonamido)-6,6-dimethyl-11-oxonaphtho[2,3-b][1]benzofuran-3-yl]ethynyl]-6-methylpyridine-4-carboxamide
- SMILES
- CC1=CC(=CC(=N1)C#CC2=CC3=C(C=C2)C4=C(O3)C(C5=C(C4=O)C=CC(=C5)NS(=O)(=O)C)(C)C)C(=O)NC(C)(C)C
- InChIKey
- DCGOHGQJHJXBGW-UHFFFAOYSA-N
- InChI
- show more
- Synonyms
- 4-Pyridinecarboxamide,2-[2-[6,11-dihydro-6,6-dimethyl-8-[(methylsulfonyl)amino]-11-oxobenzo[b]naphtho[2,...
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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.