Reaction Details Report a problem with these data
Target
C5a anaphylatoxin chemotactic receptor 1
Ligand
BDBM577792
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:
BDBM577792
Synonyms:
US11478460, Compound 1.132
Type:
Small organic molecule
Emp. Form.:
C26H22ClF3N6O
Mol. Mass.:
526.941
SMILES:
Cc1cccc(C)c1-n1nc2CCN(Cc2c1-c1cc(F)c(NC(N)=O)cc1F)c1ncc(Cl)cc1F |(-6.22,-4.42,;-4.89,-5.19,;-4.89,-6.73,;-3.55,-7.5,;-2.22,-6.73,;-2.22,-5.19,;-.89,-4.42,;-3.55,-4.42,;-3.55,-2.88,;-4.8,-1.97,;-4.32,-.51,;-5.09,.83,;-4.32,2.16,;-2.78,2.16,;-2.01,.83,;-2.78,-.51,;-2.31,-1.97,;-.82,-2.37,;-.42,-3.86,;1.07,-4.26,;1.47,-5.74,;2.16,-3.17,;3.64,-3.57,;4.73,-2.48,;6.22,-2.87,;4.33,-.99,;1.76,-1.68,;.27,-1.28,;-.13,.21,;-2.01,3.49,;-.47,3.49,;.3,4.83,;-.47,6.16,;.3,7.5,;-2.01,6.16,;-2.78,4.83,;-4.32,4.83,)|
Structure:
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