Reaction Details Report a problem with these data
Target
C5a anaphylatoxin chemotactic receptor 1
Ligand
BDBM50275644
Substrate
n/a
Meas. Tech.
ChEMBL_496808 (CHEMBL1008821)
IC50
5±n/a nM
Citation
 Blagg, J; Mowbray, C; Pryde, DC; Salmon, G; Schmid, E; Fairman, D; Beaumont, K Small, non-peptide C5a receptor antagonists: part 1. Bioorg Med Chem Lett 18:5601-4 (2008) [PubMed]  Article 
Target
Name:
C5a anaphylatoxin chemotactic receptor 1
Synonyms:
C5AR | C5AR1 | C5AR1_HUMAN | C5R1 | C5a anaphylatoxin chemotactic receptor | C5a anaphylatoxin chemotactic receptor (C5aR) | C5a-R | CD_antigen=CD88
Type:
Enzyme
Mol. Mass.:
39347.68
Organism:
Homo sapiens (Human)
Description:
P21730
Residue:
350
Sequence:
MDSFNYTTPDYGHYDDKDTLDLNTPVDKTSNTLRVPDILALVIFAVVFLVGVLGNALVVWVTAFEAKRTINAIWFLNLAVADFLSCLALPILFTSIVQHHHWPFGGAACSILPSLILLNMYASILLLATISADRFLLVFKPIWCQNFRGAGLAWIACAVAWGLALLLTIPSFLYRVVREEYFPPKVLCGVDYSHDKRRERAVAIVRLVLGFLWPLLTLTICYTFILLRTWSRRATRSTKTLKVVVAVVASFFIFWLPYQVTGIMMSFLEPSSPTFLLLKKLDSLCVSFAYINCCINPIIYVVAGQGFQGRLRKSLPSLLRNVLTEESVVRESKSFTRSTVDTMAQKTQAV
  
Inhibitor
Name:
BDBM50275644
Synonyms:
CHEMBL520715 | cis-N-(4-chlorophenethyl)-N-(1-oxaspiro[4.5]decan-8-yl)benzo[b]thiophene-3-carboxamide
Type:
Small organic molecule
Emp. Form.:
C26H28ClNO2S
Mol. Mass.:
454.024
SMILES:
Clc1ccc(CCN([C@H]2CC[C@]3(CCCO3)CC2)C(=O)c2csc3ccccc23)cc1 |r,wU:8.7,11.15,(27.33,-18.63,;26,-19.41,;26.01,-20.95,;24.68,-21.72,;23.35,-20.95,;22.02,-21.73,;20.68,-20.96,;19.35,-21.74,;19.36,-23.28,;20.69,-24.03,;20.69,-25.58,;19.35,-26.35,;20.49,-27.38,;19.86,-28.79,;18.33,-28.62,;18.01,-27.11,;18.02,-25.58,;18.02,-24.04,;18.02,-20.97,;18.01,-19.43,;16.69,-21.74,;16.53,-23.27,;15.03,-23.6,;14.25,-22.27,;12.75,-21.96,;12.27,-20.48,;13.3,-19.34,;14.81,-19.66,;15.29,-21.12,;23.33,-19.42,;24.66,-18.64,)|
Structure:
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