Targets & Pathways

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).

136,943 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 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 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 —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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Showing 3733-3744 of 136,943

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  1. NH 125
    CAS: 278603-08-0 EC Number: 636-669-6 PubChem CID: 10436839 Formula: C27H45IN2 Molecular Weight: 524.56
    ● In Stock — US Item #: N276148
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    IUPAC Name
    1-benzyl-3-hexadecyl-2-methylimidazol-1-ium;iodide
    SMILES
    CCCCCCCCCCCCCCCCN1C=C[N+](=C1C)CC2=CC=CC=C2.[I-]
    InChIKey
    RVWOHCBHAGBLLT-UHFFFAOYSA-M
    InChI
    1S/C27H45N2.HI/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-28-23-24-29(26(28)2)25-27-20-17-16-18-21-27;/h16-18,20-21,23-24H,3-15,19,22,25H2,1-2H3;1H/q+1;show more
    Synonyms
    METAPROTERENOL SULFATE [USP-RS] | A924174 | BCP29662 | Quinidate | 3-Benzyl-1-hexadecyl-2-methyl-1H-imidazol-3-iumiod...
  2. 4-O-(b-D-Mannopyranosyl)-D-glucose
    CAS: 28072-80-2 Formula: C12H22O11 Molecular Weight: 342.3
    ● In Stock — US Item #: O335179
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    SMILES
    C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](OC([C@@H]([C@H]2O)O)O)CO)O)O)O)O
    Synonyms
    BETA-D-GLUCOPYRANOSYL(1-4)-D-GLUCOPYRANOSE | 4-O-beta-D-Glucopyranosyl-D-glucose | D-Glucose, 4-O-beta-D-glucopyranos...
  3. Blonanserin, Dopamine D3 receptor antagonist
    CAS: 132810-10-7 EC Number: 685-975-6 Formula: C23H30FN3 Molecular Weight: 367.5
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%(HPLC)
    ● In Stock — US Item #: B129706
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    IUPAC Name
    2-(4-ethylpiperazin-1-yl)-4-(4-fluorophenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine
    SMILES
    CCN1CCN(CC1)C2=NC3=C(CCCCCC3)C(=C2)C4=CC=C(C=C4)F
    InChIKey
    XVGOZDAJGBALKS-UHFFFAOYSA-N
    InChI
    1S/C23H30FN3/c1-2-26-13-15-27(16-14-26)23-17-21(18-9-11-19(24)12-10-18)20-7-5-3-4-6-8-22(20)25-23/h9-12,17H,2-8,13-16H2,1H3
    Synonyms
    AKOS005145823 | Ethyl PABA | DSP-5423 | DTXSID4022652 | EX-A663 | 2-(4-ethylpiperazin-1-yl)-4-(4-fluorophenyl)-5,6,7,...
  4. RKRARKE
    CAS: 82801-73-8 PubChem CID: 134097 Formula: C38H74N18O10 Molecular Weight: 943.11
    ● In Stock — US Item #: R276094
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    IUPAC Name
    (2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-5-(diamishow more
    SMILES
    CC(C(=O)NC(CCCN=C(N)N)C(=O)NC(CCCCN)C(=O)NC(CCC(=O)O)C(=O)O)NC(=O)C(CCCN=C(N)N)NC(=O)C(CCCCN)NC(=O)C(CCCN=C(N)N)N
    InChIKey
    OUKSKNTVYYVIMZ-DUJSLOSMSA-N
    InChI
    1S/C38H74N18O10/c1-21(29(59)52-26(13-8-20-50-38(46)47)33(63)54-24(11-3-5-17-40)34(64)56-27(35(65)66)14-15-28(57)58)51-31(61)25(12-7-19-49-37(44)45)55-show more
    Synonyms
    AKOS024456827 | Arginyl-lysyl-arginyl-alanyl-arginyl-lysyl-glutamic acid | cGMP Dependent Kinase Inhibitor Peptide | ...
  5. propan-2-yl ethanesulfonate
    CAS: 14245-62-6 PubChem CID: 134677 Formula: C5H12O3S Molecular Weight: 152.21
    ● In Stock — US Item #: P302856
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    Technical Identifiers
    IUPAC Name
    propan-2-yl ethanesulfonate
    SMILES
    CCS(=O)(=O)OC(C)C
    InChIKey
    COCAPDHQLSKPBJ-UHFFFAOYSA-N
    InChI
    1S/C5H12O3S/c1-4-9(6,7)8-5(2)3/h5H,4H2,1-3H3
    Synonyms
    MFCD01728622 | Ethanesulfonic acid, 1-methylethyl ester | AKOS028108578 | EN300-245220 | propan-2-yl ethanesulfonate ...
  6. [[(4-fluorophenyl)sulfonyl](methyl)amino]acetic acid
    CAS: 287403-15-0 Formula: C9H10FNO4S Molecular Weight: 247.25
    ◐ .Made to order · 8–12 wks Item #: F393457
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    Technical Identifiers
    IUPAC Name
    2-[(4-fluorophenyl)sulfonyl-methylamino]acetic acid
    SMILES
    CN(CC(=O)O)S(=O)(=O)C1=CC=C(C=C1)F
    InChIKey
    LWYIAFIJPSFZQQ-UHFFFAOYSA-N
    InChI
    1S/C9H10FNO4S/c1-11(6-9(12)13)16(14,15)8-4-2-7(10)3-5-8/h2-5H,6H2,1H3,(H,12,13)
  7. alpha,3-Dimethylstyrene
    CAS: 1124-20-5 EC Number: 214-394-9 Formula: C10H12 Molecular Weight: 132.2
    ● In Stock — US Item #: D302222
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    IUPAC Name
    1-methyl-3-prop-1-en-2-ylbenzene
    SMILES
    CC1=CC(=CC=C1)C(=C)C
    InChIKey
    XXTQHVKTTBLFRI-UHFFFAOYSA-N
    InChI
    1S/C10H12/c1-8(2)10-6-4-5-9(3)7-10/h4-7H,1H2,2-3H3
    Synonyms
    3EY8GVM0DX | .ALPHA.,3-DIMETHYLSTYRENE | A925636 | AC1343 | .ALPHA.-METHYL-M-METHYLSTYRENE | M,.ALPHA.-DIMETHYLSTYREN...
  8. 4-(tert-Butylthio)benzaldehyde
    CAS: 88357-16-8 PubChem CID: 11401312 Formula: C11H14OS Molecular Weight: 194.29
    ● In Stock — US Item #: T344107
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    IUPAC Name
    4-tert-butylsulfanylbenzaldehyde
    SMILES
    CC(C)(C)SC1=CC=C(C=C1)C=O
    InChIKey
    RRXBEPPOMHZDBO-UHFFFAOYSA-N
    InChI
    1S/C11H14OS/c1-11(2,3)13-10-6-4-9(8-12)5-7-10/h4-8H,1-3H3
    Synonyms
    AKOS005070625 | MFCD08443944 | 4-tert-butylsulfanylbenzaldehyde | DTXSID20464706 | 4-(tert-Butylsulfanyl)benzenecarba...
  9. alpha-(1-Naphthyl)benzylamine
    CAS: 2936-63-2 Formula: C17H15N Molecular Weight: 233.31
    ◐ .Made to order · 8–12 wks Item #: A294590
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    IUPAC Name
    naphthalen-1-yl(phenyl)methanamine
    SMILES
    C1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N
    InChIKey
    MKYLPACDIKGXSW-UHFFFAOYSA-N
    InChI
    1S/C17H15N/c18-17(14-8-2-1-3-9-14)16-12-6-10-13-7-4-5-11-15(13)16/h1-12,17H,18H2
    Synonyms
    1-(NAPHTHALEN-1-YL)-1-PHENYLMETHANAMINE | naphthalen-1-yl(phenyl)methanamine | SY019153 | A876484 | Oprea1_421612 | D...
  10. iso-PPADS tetrasodium salt
    CAS: 207572-67-6 Formula: C14H10N3Na4O12PS2 Molecular Weight: 599.3
    ◐ .Made to order · 8–12 wks Item #: I288662
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    IUPAC Name
    tetrasodium;2-[[4-formyl-5-hydroxy-6-methyl-3-(phosphonatooxymethyl)pyridin-2-yl]diazenyl]benzene-1,4-disulfonate
    SMILES
    CC1=C(C(=C(C(=N1)N=NC2=C(C=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])COP(=O)([O-])[O-])C=O)O.[Na+].[Na+].[Na+].[Na+]
    InChIKey
    SDCXIPVOUDBGDK-UHFFFAOYSA-J
    InChI
    1S/C14H14N3O12PS2.4Na/c1-7-13(19)9(5-18)10(6-29-30(20,21)22)14(15-7)17-16-11-4-8(31(23,24)25)2-3-12(11)32(26,27)28;;;;/h2-5,19H,6H2,1H3,(H2,20,21,22)(show more
    Synonyms
    Pyridoxalphosphate-6-azophenyl-2',5'-disulfonic acid tetrasodium salt
  11. meso-Tetratolylporphyrin-Mn(III)chloride
    CAS: 43145-44-4 PubChem CID: 135741312 Formula: C48H36ClMnN4 Molecular Weight: 759.21
    Solid ≥97%
    ● In Stock — US Item #: T303716
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    IUPAC Name
    manganese(3+);5,10,15,20-tetrakis(4-methylphenyl)-21,23-dihydroporphyrin;trichloride
    SMILES
    CC1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C)C8=CC=C(C=C8)C)C=C4)C9=CC=C(C=C9)C)N3.[Cl-].[Cl-].[Cl-].[Mn+3]
    InChIKey
    RQVBWQJSJSBIQU-UHFFFAOYSA-K
    InChI
    1S/C48H38N4.3ClH.Mn/c1-29-5-13-33(14-6-29)45-37-21-23-39(49-37)46(34-15-7-30(2)8-16-34)41-25-27-43(51-41)48(36-19-11-32(4)12-20-36)44-28-26-42(52-44)4show more
    Synonyms
    5,10,15,20-Tetra(4-methylphenyl)-21H,23H-porphine manganese(III) chloride
  12. methyl 3-fluoropyrrolidine-3-carboxylate hydrochloride
    CAS: 1375473-59-8 PubChem CID: 73994692 Formula: C6H10NO2F•HCl Molecular Weight: 183.61
    ◐ .Made to order · 8–12 wks Item #: M302516
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    Technical Identifiers
    IUPAC Name
    methyl 3-fluoropyrrolidine-3-carboxylate;hydrochloride
    SMILES
    COC(=O)C1(CCNC1)F.Cl
    InChIKey
    WGBZGVYPTPACTL-UHFFFAOYSA-N
    InChI
    1S/C6H10FNO2.ClH/c1-10-5(9)6(7)2-3-8-4-6;/h8H,2-4H2,1H3;1H
    Synonyms
    AKOS024015528 | EN300-96908 | methyl 3-fluoropyrrolidine-3-carboxylate;hydrochloride | methyl3-fluoropyrrolidine-3-ca...
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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.
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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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