crisaborole [Ligand Id: 9151] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL484785 (AN-2728, AN2728, Crisaborole, Eucrisa) |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| Beta-lactamase in Klebsiella pneumoniae (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1641358] [UniProtKB: Q93LQ9] | ||||||||
| ChEMBL | Inhibition of Klebsiella pneumoniae KPC-2 | B | 6.17 | pIC50 | 670 | nM | IC50 | Bioorg Med Chem Lett (2021) 41: 127956-127956 [PMID:33744439] |
| phosphodiesterase 1A/Phosphodiesterase 1A in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3421] [GtoPdb: 1294] [UniProtKB: P54750] | ||||||||
| GtoPdb | - | - | 5.21 | pIC50 | 6100 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 2129-32 [PMID:19303290] |
| ChEMBL | Inhibition of human recombinant PDE1A3 expressed in baculovirus-infected insect Sf9 cells by modified two-step method | B | 5.21 | pIC50 | 6100 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 2129-2132 [PMID:19303290] |
| phosphodiesterase 4A/Phosphodiesterase 4A in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL254] [GtoPdb: 1300] [UniProtKB: P27815] | ||||||||
| ChEMBL | Inhibition of PDE4A1A (unknown origin) | B | 7.26 | pIC50 | 55 | nM | IC50 | J Med Chem (2018) 61: 10375-10384 [PMID:30052440] |
| phosphodiesterase 4B/Phosphodiesterase 4B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL275] [GtoPdb: 1301] [UniProtKB: Q07343] | ||||||||
| ChEMBL | Inhibition of PDE4B (unknown origin) | B | 4.15 | pIC50 | 70000 | nM | IC50 | Eur J Med Chem (2021) 213: 113171-113171 [PMID:33482600] |
| ChEMBL | Inhibition of PDE4B (unknown origin) assessed as hydrolysis of [3H]-cGMP into [3H]-GMP incubated for 30 mins by scintillation of proximity assay | B | 7.24 | pIC50 | 57.2 | nM | IC50 | Eur J Med Chem (2021) 213: 113171-113171 [PMID:33482600] |
| ChEMBL | Inhibition of PDE4B2 (unknown origin) | B | 7.26 | pIC50 | 55 | nM | IC50 | J Med Chem (2018) 61: 10375-10384 [PMID:30052440] |
| ChEMBL | Inhibition of PDE4B1 (unknown origin) | B | 7.26 | pIC50 | 55 | nM | IC50 | J Med Chem (2018) 61: 10375-10384 [PMID:30052440] |
| phosphodiesterase 4C/Phosphodiesterase 4C in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL291] [GtoPdb: 1302] [UniProtKB: Q08493] | ||||||||
| ChEMBL | Inhibition of PDE4C1 (unknown origin) | B | 7.26 | pIC50 | 55 | nM | IC50 | J Med Chem (2018) 61: 10375-10384 [PMID:30052440] |
| phosphodiesterase 4D/Phosphodiesterase 4D in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL288] [GtoPdb: 1303] [UniProtKB: Q08499] | ||||||||
| ChEMBL | Inhibition of PDE4D7 (unknown origin) | B | 7.26 | pIC50 | 55 | nM | IC50 | J Med Chem (2018) 61: 10375-10384 [PMID:30052440] |
| phosphodiesterase 7A/Phosphodiesterase 7A in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3012] [GtoPdb: 1305] [UniProtKB: Q13946] | ||||||||
| ChEMBL | Inhibition of human recombinant PDE7A1 expressed in baculovirus-infected insect Sf9 cells by modified two-step method | B | 6.14 | pIC50 | 730 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 2129-2132 [PMID:19303290] |
| GtoPdb | - | - | 6.14 | pIC50 | 730 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 2129-32 [PMID:19303290] |
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]
