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
24,639Navigate 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
2,815PROTAC 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
102,615Explore 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
- Pardaxin TFA saltCAS: 67995-63-5(free base) Formula: C156H250N36O47(free base) Molecular Weight: 3381.87(free base)● In Stock — US warehouse, ships to EU* Item #: P491924View ProductPricing & Pack Sizes
Technical Identifiers
- Perilla oilCAS: 68132-21-8 Formula:containing 40-55% perilla aldehyde● In Stock — US warehouse, ships to EU* Item #: P573484View ProductPricing & Pack Sizes
Technical Identifiers
- 3-Phenoxymandelic acid● In Stock — US warehouse, ships to EU* Item #: P492384View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2-hydroxy-2-(3-phenoxyphenyl)acetic acid
- SMILES
- C1=CC=C(C=C1)OC2=CC=CC(=C2)C(C(=O)O)O
- InChIKey
- FPUCYPXKIFVDSD-UHFFFAOYSA-N
- InChI
- 1S/C14H12O4/c15-13(14(16)17)10-5-4-8-12(9-10)18-11-6-2-1-3-7-11/h1-9,13,15H,(H,16,17)
- Synonyms
- RARECHEM AL BO 1082;3-PHENOXYMANDELIC ACID;Benzeneacetic acid, α-hydroxy-3-phenoxy-;2-Hydroxy-2-(3-phenoxyphenyl)acet...
- Palomid 529 (P529), Serine/threonine-protein kinase mTOR inhibitorCAS: 914913-88-5 Formula: C24H22O6 Molecular Weight: 406.4310mM in DMSO◐ .Made to order · 8–12 wks Item #: P580480View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 8-(1-hydroxyethyl)-2-methoxy-3-[(4-methoxyphenyl)methoxy]benzo[c]chromen-6-one
- SMILES
- CC(C1=CC2=C(C=C1)C3=CC(=C(C=C3OC2=O)OCC4=CC=C(C=C4)OC)OC)O
- InChIKey
- YEAHTLOYHVWAKW-UHFFFAOYSA-N
- InChI
- 1S/C24H22O6/c1-14(25)16-6-9-18-19-11-22(28-3)23(12-21(19)30-24(26)20(18)10-16)29-13-15-4-7-17(27-2)8-5-15/h4-12,14,25H,13H2,1-3H3
- Synonyms
- 8-(1-hydroxyethyl)-2-methoxy-3-((4-methoxyphenyl)methoxy)-6h-dibenzo(b,d)pyran-6-one | (z)-ocimene | Oroxylin A, >=98...
- PeiminineCAS: 18059-10-4 Formula: C27H43NO3 Molecular Weight: 429.64◐ .Made to order · 8–12 wks Item #: P579447View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (1R,2S,6S,9S,10S,11S,14S,15S,18S,20S,23R,24S)-10,20-dihydroxy-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosan-17-one
- SMILES
- CC1CCC2C(C3CCC4C(C3CN2C1)CC5C4CC(=O)C6C5(CCC(C6)O)C)(C)O
- InChIKey
- IQDIERHFZVCNRZ-YUYPDVIUSA-N
- InChI
- show more
- Synonyms
- IMPERIALINE [MI] | 3beta,20-Dihydroxy-5alpha-cevan-6-one | Cevan-6-one, 3,20-dihydroxy-, (3.beta.,5.alpha.)- | QUB07U...
- PP1, Inhibitor of C-terminal Src kinase;Inhibitor of epidermal growth factor receptor;Inhibitor of FYN proto-oncogene; Src family tyrosine kinase;Inhibitor of LCK proto-oncogene; Src family tyrosine kinase;Inhibitor of mitogen-activated protein kinase 14;InhibMoligand™ ? 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 #: P580479View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 1-tert-butyl-3-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
- SMILES
- CC1=CC=C(C=C1)C2=NN(C3=NC=NC(=C23)N)C(C)(C)C
- InChIKey
- ZVPDNRVYHLRXLX-UHFFFAOYSA-N
- InChI
- 1S/C16H19N5/c1-10-5-7-11(8-6-10)13-12-14(17)18-9-19-15(12)21(20-13)16(2,3)4/h5-9H,1-4H3,(H2,17,18,19)
- Synonyms
- 1-(tert-Butyl)-3-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine | 12L-341S | 4-AMINO-1-TERT-BUTYL-3-(4-METHYLPHENYL)PY...
- Prochlorperazine Dimaleate, Dopamine D2 receptor antagonistCAS: 84-02-6 EC Number: 201-511-3 PubChem CID: 5281032 Formula: C20H24ClN3S·2C4H4O4 Molecular Weight: 606.0910mM in DMSO● In Stock — US warehouse, ships to EU* Item #: P580495View ProductPricing & Pack Sizes
Technical Identifiers
- Synonyms
- 2-CHLORO-10-(3-(4-METHYL-1-PIPERAZINYL)PROPYL)PHENOTHIAZINE MALEATE (1:2). | Prochlorperazine maleate, British Pharma...
- Propargyl alcohol propoxylate● In Stock — Germany Item #: P579546View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 2-prop-2-ynoxypropan-1-ol
- SMILES
- CC(CO)OCC#C
- InChIKey
- JVSJDKRMKRFRBT-UHFFFAOYSA-N
- InChI
- 1S/C6H10O2/c1-3-4-8-6(2)5-7/h1,6-7H,4-5H2,2H3
- Synonyms
- Propargyl alcohol propoxylate|3973-17-9|2-prop-2-ynoxypropan-1-ol|2-(PROP-2-YN-1-YLOXY)PROPAN-1-OL|19082-35-0|SCHEMBL...
- PF-06928215, Inhibitor of Cyclic GMP-AMP synthaseLiquid 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 #: P580478View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- (1R,2S)-2-[(7-oxo-5-phenyl-1H-pyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
- SMILES
- C1CCC(C(C1)C(=O)O)NC(=O)C2=CNN3C2=NC(=CC3=O)C4=CC=CC=C4
- InChIKey
- WGQGCLHXUPGUSZ-HIFRSBDPSA-N
- InChI
- show more
- Phytic acid sodium salt hydrateLiquid 10mM in Water● In Stock — US warehouse, ships to EU* Item #: P580487View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- dodecasodium;(2,3,4,5,6-pentaphosphonatooxycyclohexyl) phosphate
- SMILES
- show more
- InChIKey
- KETSPIPODMGOEJ-UHFFFAOYSA-B
- InChI
- show more
- Synonyms
- CCRIS 6849 | Dodecasodium (1R,2R,3r,4S,5S,6s)-1,2,3,4,5,6-cyclohexanehexayl hexakis(phosphate) | Sodium fytate (12:1)...
- Pristimerin10mM in DMSO● In Stock — US warehouse, ships to EU* Item #: P580494View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- methyl (2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylate
- SMILES
- CC1=C(C(=O)C=C2C1=CC=C3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C(=O)OC)C)C)C)C)O
- InChIKey
- JFACETXYABVHFD-WXPPGMDDSA-N
- InChI
- show more
- Synonyms
- BDBM50481947 | Spectrum2_000546 | CELASTROL METHYL ESTER [MI] | NCGC00178090-01 | Pristimerin | NSC-99281 | AC-34029 ...
- PD-169316CAS: 152121-53-4 EC Number: 633-972-5 PubChem CID: 4712 Formula: C20H13FN4O2 Molecular Weight: 360.34Moligand™ ? 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 #: P580477View ProductPricing & Pack Sizes
Technical Identifiers
- IUPAC Name
- 4-[4-(4-fluorophenyl)-2-(4-nitrophenyl)-1H-imidazol-5-yl]pyridine
- SMILES
- C1=CC(=CC=C1C2=NC(=C(N2)C3=CC=NC=C3)C4=CC=C(C=C4)F)[N+](=O)[O-]
- InChIKey
- BGIYKDUASORTBB-UHFFFAOYSA-N
- InChI
- 1S/C20H13FN4O2/c21-16-5-1-13(2-6-16)18-19(14-9-11-22-12-10-14)24-20(23-18)15-3-7-17(8-4-15)25(26)27/h1-12H,(H,23,24)
- Synonyms
- AC-31396 | BRD-K77133231-001-01-1 | HMS3649N16 | SY235161 | CCG-206874 | EX-A219 | ES-0028 | Pyridine,4-[4-(4-fluorop...
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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.