Reaction Details Report a problem with these data
Target
C5a anaphylatoxin chemotactic receptor 1
Ligand
BDBM577809
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:
BDBM577809
Synonyms:
US11478460, Compound 1.149
Type:
Small organic molecule
Emp. Form.:
C33H37F2N5O2
Mol. Mass.:
573.676
SMILES:
CCc1cccc(CC)c1-n1nc2CCN(Cc2c1-c1cc(F)c(NC(N)=O)cc1F)C(C)(C)c1ccccc1OC |(-6.93,-4.52,;-5.6,-3.75,;-4.26,-4.52,;-4.26,-6.06,;-2.93,-6.83,;-1.6,-6.06,;-1.6,-4.52,;-.26,-3.75,;1.07,-4.52,;-2.93,-3.75,;-2.93,-2.21,;-4.18,-1.3,;-3.7,.16,;-4.47,1.49,;-3.7,2.83,;-2.16,2.83,;-1.39,1.49,;-2.16,.16,;-1.69,-1.3,;-.2,-1.7,;.2,-3.19,;1.69,-3.59,;2.09,-5.08,;2.78,-2.5,;4.26,-2.9,;5.6,-2.13,;6.93,-2.9,;5.6,-.59,;2.38,-1.01,;.89,-.61,;.49,.87,;-1.39,4.16,;-2.48,5.25,;-.99,5.65,;.15,4.16,;.92,2.83,;2.46,2.83,;3.23,4.16,;2.46,5.5,;.92,5.5,;.15,6.83,;1.14,8.01,)|
Structure:
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