Reaction Details Report a problem with these data
Target
C-X-C chemokine receptor type 1
Ligand
BDBM50233558
Substrate
n/a
Meas. Tech.
ChEMBL_462399 (CHEMBL927215)
IC50
171±n/a nM
Citation
Yu, Y; Dwyer, MP; Chao, J; Aki, C; Chao, J; Purakkattle, B; Rindgen, D; Bond, R; Mayer-Ezel, R; Jakway, J; Qiu, H; Hipkin, RW; Fossetta, J; Gonsiorek, W; Bian, H; Fan, X; Terminelli, C; Fine, J; Lundell, D; Merritt, JR; He, Z; Lai, G; Wu, M; Taveras, A Synthesis and structure-activity relationships of heteroaryl substituted-3,4-diamino-3-cyclobut-3-ene-1,2-dione CXCR2/CXCR1 receptor antagonists. Bioorg Med Chem Lett 18:1318-22 (2008) [PubMed] Article
More Info.:
Target
Name:
C-X-C chemokine receptor type 1
Synonyms:
C-X-C chemokine receptor type 1 (CXCR-1) | C-X-C chemokine receptor type 1 (CXCR1) | CMKAR1 | CXCR1 | CXCR1_HUMAN | IL8RA | Interleukin-8 receptor A | Interleukin-8 receptors, CXCR1/CXCR2
Type:
Enzyme
Mol. Mass.:
39803.83
Organism:
Homo sapiens (Human)
Description:
P25024
Residue:
350
Sequence:
MSNITDPQMWDFDDLNFTGMPPADEDYSPCMLETETLNKYVVIIAYALVFLLSLLGNSLVMLVILYSRVGRSVTDVYLLNLALADLLFALTLPIWAASKVNGWIFGTFLCKVVSLLKEVNFYSGILLLACISVDRYLAIVHATRTLTQKRHLVKFVCLGCWGLSMNLSLPFFLFRQAYHPNNSSPVCYEVLGNDTAKWRMVLRILPHTFGFIVPLFVMLFCYGFTLRTLFKAHMGQKHRAMRVIFAVVLIFLLCWLPYNLVLLADTLMRTQVIQESCERRNNIGRALDATEILGFLHSCLNPIIYAFIGQNFRHGFLKILAMHGLVSKEFLARHRVTSYTSSSVNVSSNL
Inhibitor
Name:
BDBM50233558
Synonyms:
(R)-2-hydroxy-N,N-dimethyl-3-(2-(1-(5-methylisoxazol-3-yl)propylamino)-3,4-dioxocyclobut-1-enylamino)benzamide | CHEMBL253927
Type:
Small organic molecule
Emp. Form.:
C20H22N4O5
Mol. Mass.:
398.4125
SMILES:
CC[C@@H](Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)c1cc(C)on1