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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137,006 products

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

2,814

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. STRONTIUM OXALATE MONOHYDRATE
    CAS: 6160-36-7 PubChem CID: 516791 Formula: C2H2O5Sr Molecular Weight: 193.65
    Solid ≥99%
    ● In Stock — Germany Item #: S304156
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    Technical Identifiers
    IUPAC Name
    strontium;oxalate;hydrate
    SMILES
    C(=O)(C(=O)[O-])[O-].O.[Sr+2]
    InChIKey
    PZUKVOYOCQDYEL-UHFFFAOYSA-L
    InChI
    1S/C2H2O4.H2O.Sr/c3-1(4)2(5)6;;/h(H,3,4)(H,5,6);1H2;/q;;+2/p-2
    Synonyms
    Strontium oxalate monohydrate|6160-36-7|strontium oxalate hydrate|strontium;oxalate;hydrate|Strontium oxalate monohyd...
  2. Oglemilast, Phosphodiesterase 4 inhibitor
    CAS: 778576-62-8 Formula: C20H13Cl2F2N3O5S Molecular Weight: 516.30
    ● In Stock — US warehouse, ships to EU* Item #: O127359
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    IUPAC Name
    N-(3,5-dichloropyridin-4-yl)-4-(difluoromethoxy)-8-(methanesulfonamido)dibenzofuran-1-carboxamide
    SMILES
    CS(=O)(=O)NC1=CC2=C(C=C1)OC3=C(C=CC(=C23)C(=O)NC4=C(C=NC=C4Cl)Cl)OC(F)F
    InChIKey
    OKFDRAHPFKMAJH-UHFFFAOYSA-N
    InChI
    1S/C20H13Cl2F2N3O5S/c1-33(29,30)27-9-2-4-14-11(6-9)16-10(3-5-15(18(16)31-14)32-20(23)24)19(28)26-17-12(21)7-25-8-13(17)22/h2-8,20,27H,1H3,(H,25,26,28)
    Synonyms
    BCP21392 | UNII-67GXQ6WCC6 | NCGC00379066-01 | GRC3886 | GRC-3886 | 4-difluoromethoxy-8-methanesulfonylamino-dibenzof...
  3. SRPIN340
    CAS: 218156-96-8 EC Number: 808-979-3 PubChem CID: 2797577 Formula: C18H18F3N3O Molecular Weight: 349.35
    ● In Stock — US warehouse, ships to EU* Item #: S125426
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    IUPAC Name
    N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]pyridine-4-carboxamide
    SMILES
    C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=CC=NC=C3
    InChIKey
    DWFGGOFPIISJIT-UHFFFAOYSA-N
    InChI
    1S/C18H18F3N3O/c19-18(20,21)14-4-5-16(24-10-2-1-3-11-24)15(12-14)23-17(25)13-6-8-22-9-7-13/h4-9,12H,1-3,10-11H2,(H,23,25)
    Synonyms
    BCP08400 | AKOS024262286 | AS-16588 | N-(2-(Piperidin-1-yl)-5-(trifluoromethyl)phenyl)isonicotinamide | FT-0700266 | ...
  4. SRT 1460
    CAS: 925432-73-1 PubChem CID: 24180124 Formula: C26H29N5O4S Molecular Weight: 507.62
    ● In Stock — US warehouse, ships to EU* Item #: S334321
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    IUPAC Name
    3,4,5-trimethoxy-N-[2-[3-(piperazin-1-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl]benzamide
    SMILES
    COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=CC=C2C3=CN4C(=CSC4=N3)CN5CCNCC5
    InChIKey
    SBEWVVLMFLTQFE-UHFFFAOYSA-N
    InChI
    1S/C26H29N5O4S/c1-33-22-12-17(13-23(34-2)24(22)35-3)25(32)28-20-7-5-4-6-19(20)21-15-31-18(16-36-26(31)29-21)14-30-10-8-27-9-11-30/h4-7,12-13,15-16,27Hshow more
    Synonyms
    BRD-K20979596-019-01-6 | MFCD19053214 | SCHEMBL1302286 | 3,4,5-Trimethoxy-N-(2-(3-(piperazin-1-ylmethyl)-imidazo[2,1-...
  5. SRT3190
    CAS: 1204707-73-2 PubChem CID: 59149652 Formula: C18H23F2N5O4S2 Molecular Weight: 475.54
    ◐ .Made to order · 8–12 wks Item #: S128077
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    IUPAC Name
    N-[2-[(2,3-difluorophenyl)methylsulfanyl]-6-[[(2S,3R)-3,4-dihydroxybutan-2-yl]amino]pyrimidin-4-yl]azetidine-1-sulfonamide
    SMILES
    CC(C(CO)O)NC1=CC(=NC(=N1)SCC2=C(C(=CC=C2)F)F)NS(=O)(=O)N3CCC3
    InChIKey
    QVKPEMXUBULFBM-FZMZJTMJSA-N
    InChI
    1S/C18H23F2N5O4S2/c1-11(14(27)9-26)21-15-8-16(24-31(28,29)25-6-3-7-25)23-18(22-15)30-10-12-4-2-5-13(19)17(12)20/h2,4-5,8,11,14,26-27H,3,6-7,9-10H2,1H3show more
    Synonyms
    AKOS030526316 | MS-28821 | 1204707-73-2 | N-(2-{[(2,3-Difluorophenyl)methyl]sulfanyl}-6-{[(2S,3R)-3,4-dihydroxybutan-...
  6. SSR128129E
    CAS: 848318-25-2 PubChem CID: 68853159 Formula: C18H15N2NaO4 Molecular Weight: 346.31
    ● In Stock — US warehouse, ships to EU* Item #: S275943
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    IUPAC Name
    sodium;2-amino-5-(1-methoxy-2-methylindolizine-3-carbonyl)benzoate
    SMILES
    CC1=C(N2C=CC=CC2=C1OC)C(=O)C3=CC(=C(C=C3)N)C(=O)[O-].[Na+]
    InChIKey
    JFBMSTWZURKQOC-UHFFFAOYSA-M
    InChI
    1S/C18H16N2O4.Na/c1-10-15(20-8-4-3-5-14(20)17(10)24-2)16(21)11-6-7-13(19)12(9-11)18(22)23;/h3-9H,19H2,1-2H3,(H,22,23);/q;+1/p-1
    Synonyms
    2-Amino-5-(1-methoxy-2-methylindolizine-3-carbonyl)benzoatesodiumsalt | sodium | 2-amino-5-(1-methoxy-2-methylindoliz...
  7. SR 13800
    CAS: 227321-12-2 PubChem CID: 5282542 Formula: C25H29N3O2S Molecular Weight: 435.58
    ● In Stock — US warehouse, ships to EU* Item #: S288591
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    IUPAC Name
    5-(3-hydroxypropylsulfanyl)-3-methyl-1-(2-methylpropyl)-6-(naphthalen-1-ylmethyl)pyrrolo[3,4-d]pyridazin-4-one
    SMILES
    CC(C)CC1=NN(C(=O)C2=C(N(C=C12)CC3=CC=CC4=CC=CC=C43)SCCCO)C
    InChIKey
    VDAVMXLEMHVXOG-UHFFFAOYSA-N
    InChI
    1S/C25H29N3O2S/c1-17(2)14-22-21-16-28(15-19-10-6-9-18-8-4-5-11-20(18)19)25(31-13-7-12-29)23(21)24(30)27(3)26-22/h4-6,8-11,16-17,29H,7,12-15H2,1-3H3
    Synonyms
    MCT1-IN-2
  8. SR 140333
    CAS: 153050-21-6 PubChem CID: 108166 Formula: C37H45Cl3N2O2 Molecular Weight: 656.12
    ◐ .Made to order · 8–12 wks Item #: S287620
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    IUPAC Name
    1-[(3S)-3-(3,4-dichlorophenyl)-3-[2-(4-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethyl]piperidin-1-yl]-2-(3-propan-2-yloxyphenyl)ethanone;chloride
    SMILES
    CC(C)OC1=CC=CC(=C1)CC(=O)N2CCCC(C2)(CC[N+]34CCC(CC3)(CC4)C5=CC=CC=C5)C6=CC(=C(C=C6)Cl)Cl.[Cl-]
    InChIKey
    NQHFSECYQAQZBN-LSYPWIJNSA-M
    InChI
    1S/C37H45Cl2N2O2.ClH/c1-28(2)43-32-11-6-8-29(24-32)25-35(42)40-19-7-14-37(27-40,31-12-13-33(38)34(39)26-31)18-23-41-20-15-36(16-21-41,17-22-41)30-9-4-show more
    Synonyms
    SR 140333 | 1-[(3S)-3-(3,4-dichlorophenyl)-3-[2-(4-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethyl]piperidin-1-yl]-2-(3...
  9. SR 202
    CAS: 76541-72-5 PubChem CID: 60910 Formula: C11H17ClO7P2 Molecular Weight: 358.65
    ● In Stock — US warehouse, ships to EU* Item #: S288929
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    IUPAC Name
    [(4-chlorophenyl)-dimethoxyphosphorylmethyl] dimethyl phosphate
    SMILES
    COP(=O)(C(C1=CC=C(C=C1)Cl)OP(=O)(OC)OC)OC
    InChIKey
    VQHUQHAPWMNBLP-UHFFFAOYSA-N
    InChI
    1S/C11H17ClO7P2/c1-15-20(13,16-2)11(19-21(14,17-3)18-4)9-5-7-10(12)8-6-9/h5-8,11H,1-4H3
    Synonyms
    [(4-chlorophenyl)-dimethoxyphosphorylmethyl] dimethyl phosphate | Dimethyl .alpha.-(dimethoxyphosphinyl)-p-chlorobenz...
  10. SR 2640 hydrochloride
    CAS: 146662-42-2 Formula: C23H18N2O3.HCl Molecular Weight: 406.87
    ● In Stock — US warehouse, ships to EU* Item #: S286801
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    IUPAC Name
    2-[3-(quinolin-2-ylmethoxy)anilino]benzoic acid;hydrochloride
    SMILES
    C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=CC(=C3)NC4=CC=CC=C4C(=O)O.Cl
    InChIKey
    KDSYWFCTUKABKE-UHFFFAOYSA-N
    InChI
    1S/C23H18N2O3.ClH/c26-23(27)20-9-2-4-11-22(20)24-17-7-5-8-19(14-17)28-15-18-13-12-16-6-1-3-10-21(16)25-18;/h1-14,24H,15H2,(H,26,27);1H
    Synonyms
    2-[[3-(2-Quinolinylmethoxy)phenyl]amino]benzoic acid hydrochloride | 2-((3-(quinolin-2-ylmethoxy)phenyl)amino)benzoic...
  11. PD-1/PD-L1 Inhibitor 3 TFA
    CAS: 1629654-95-0(free base) Formula: C91H127F3N24O20S Molecular Weight: 1966.19
    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 #: P276257
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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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