serlopitant [Ligand Id: 9280] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL447955 (MK-0594, Serlopitant, Vpd-737, VPD-737) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| NK1 receptor/Neurokinin 1 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL249] [GtoPdb: 360] [UniProtKB: P25103] | ||||||||
| ChEMBL | Displacement of [125I]substance P human recombinant NK1 receptor expressed in CHO cells in presence of human serum albumin | B | 8.02 | pIC50 | 9.5 | nM | IC50 | J Med Chem (2009) 52: 3039-3046 [PMID:19354254] |
| ChEMBL | Displacement of [125I]substance P from human NK1 receptor expressed in CHO cells in presence of human serum | B | 8.02 | pIC50 | 9.5 | nM | IC50 | J Med Chem (2013) 56: 5940-5948 [PMID:23808489] |
| GtoPdb | Inhibition of binding of 125I-Substance P in vitro. | - | 10.22 | pIC50 | 0.06 | nM | IC50 | J Med Chem (2009) 52: 3039-46 [PMID:19354254] |
| ChEMBL | Displacement of [125I]substance P human recombinant NK1 receptor expressed in CHO cells in absence of human serum albumin | B | 10.22 | pIC50 | 0.06 | nM | IC50 | J Med Chem (2009) 52: 3039-3046 [PMID:19354254] |
| ChEMBL | Displacement of [125I]substance P from human NK1 receptor expressed in CHO cells | B | 10.22 | pIC50 | 0.06 | nM | IC50 | J Med Chem (2013) 56: 5940-5948 [PMID:23808489] |
| NK2 receptor/Neurokinin 2 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2327] [GtoPdb: 361] [UniProtKB: P21452] | ||||||||
| ChEMBL | Binding affinity to human NK2 receptor | B | 8.62 | pKi | 2.4 | nM | Ki | J Med Chem (2009) 52: 3039-3046 [PMID:19354254] |
| ChEMBL | Binding affinity to human NK2 receptor | B | 5.62 | pIC50 | 2400 | nM | IC50 | J Med Chem (2013) 56: 5940-5948 [PMID:23808489] |
| NK3 receptor/Neurokinin 3 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4429] [GtoPdb: 362] [UniProtKB: P29371] | ||||||||
| ChEMBL | Binding affinity to human NK3 receptor | B | 8.62 | pKi | 2.4 | nM | Ki | J Med Chem (2009) 52: 3039-3046 [PMID:19354254] |
| ChEMBL | Binding affinity to human NK3 receptor | B | 5.62 | pIC50 | 2400 | nM | IC50 | J Med Chem (2013) 56: 5940-5948 [PMID:23808489] |
ChEMBL data shown on this page come from version 33:
Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]
