Reaction Details Report a problem with these data
Target
C5a anaphylatoxin chemotactic receptor 1
Ligand
BDBM577808
Substrate
n/a
Meas. Tech.
chemotaxis assay
IC50
<5±n/a nM
Citation
 Fan, P; Lange, CW; Malathong, V; Mali, VR; Punna, S; Tanaka, H; Zeng, Y; Zhang, P Diaryl substituted 6,5-fused ring compounds as C5aR inhibitors US Patent  US11478460 Publication Date 10/25/2022 
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:
BDBM577808
Synonyms:
US11478460, Compound 1.148
Type:
Small organic molecule
Emp. Form.:
C32H33F2N5O3
Mol. Mass.:
573.6329
SMILES:
CCc1cccc(CC)c1-n1nc2CCN(Cc2c1-c1cc(F)c(NC(N)=O)cc1F)C(C(=O)OC)c1ccccc1 |(-4.39,5.25,;-3.62,3.91,;-4.39,2.58,;-5.93,2.58,;-6.7,1.24,;-5.93,-.09,;-4.39,-.09,;-3.62,-1.42,;-4.39,-2.76,;-3.62,1.24,;-2.08,1.24,;-1.17,2.49,;.29,2.01,;1.63,2.78,;2.96,2.01,;2.96,.47,;1.63,-.3,;.29,.47,;-1.17,-0,;-1.65,-1.47,;-.62,-2.61,;-1.09,-4.07,;-.06,-5.22,;-2.6,-4.4,;-3.08,-5.86,;-4.58,-6.18,;-5.61,-5.04,;-5.06,-7.64,;-3.63,-3.25,;-3.16,-1.79,;-4.19,-.64,;4.29,-.3,;5.63,.47,;5.63,2.01,;6.96,-.3,;8.29,.47,;4.29,-1.84,;2.96,-2.61,;2.96,-4.15,;4.29,-4.92,;5.63,-4.15,;5.63,-2.61,)|
Structure:
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