BOP [Ligand Id: 12045] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL288474 |
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| DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
|---|---|---|---|---|---|---|---|---|
| integrin, beta 1 subunit (fibronectin receptor, beta polypeptide, antigen CD29 includes MDF2, MSK12)/integrin, alpha 4 subunit (antigen CD49D, alpha 4 subunit of VLA-4 receptor)/Integrin alpha-4/beta-1 in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL1907599] [GtoPdb: 2455, 2443] [UniProtKB: P05556, P13612] | ||||||||
| ChEMBL | Alpha4-beta1 integrin binding affinity was assessed by measuring the reduction in binding of [125I]VCAM-Ig to a suspension of Jurkat cells (a human T cell line alpha-4-beta-1-beta-7) | B | 9.85 | pIC50 | 0.14 | nM | IC50 | Bioorg Med Chem Lett (2002) 12: 159-163 [PMID:11755344] |
| integrin, alpha 4 subunit (antigen CD49D, alpha 4 subunit of VLA-4 receptor)/integrin, beta 7 subunit/Integrin alpha-4/beta-7 in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL2095184] [GtoPdb: 2443, 2461] [UniProtKB: P13612, P26010] | ||||||||
| ChEMBL | Alpha4-beta7 integrin binding affinity was determined in duplicate by a radioligand binding assay using [125I]-VCAM-Ig and a suspension of RPMI-8866 cells (a human B cell line alpha-4-beta-1-beta-7+) | B | 8.55 | pIC50 | 2.83 | nM | IC50 | Bioorg Med Chem Lett (2002) 12: 159-163 [PMID:11755344] |
| integrin, alpha 9 subunit in Human [GtoPdb: 2448] [UniProtKB: Q13797] | ||||||||
| GtoPdb | Binding affinity for α9β1 intergrin in vitro | - | 11.52 | pKd | 0 | nM | Kd | Biochemistry (2002) 41: 7125-41 [PMID:12033947] |
| integrin α4β1 in Human [GtoPdb: 2580] | ||||||||
| GtoPdb | - | - | 11.3 | pKd | 0 | nM | Kd | Biochemistry (2002) 41: 7125-41 [PMID:12033947] |
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]
