Reaction Details Report a problem with these data
Target
C5a anaphylatoxin chemotactic receptor 1
Ligand
BDBM577805
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:
BDBM577805
Synonyms:
US11478460, Compound 1.145
Type:
Small organic molecule
Emp. Form.:
C33H37F2N5O2
Mol. Mass.:
573.676
SMILES:
CCC(N1CCc2nn(c(c2C1)-c1cc(F)c(NC(N)=O)cc1F)-c1c(C)cccc1OCC(C)C)c1ccccc1 |(-2.32,6.16,;-.78,6.16,;-.01,4.83,;-.78,3.49,;-2.32,3.49,;-3.09,2.16,;-2.32,.83,;-2.8,-.64,;-1.55,-1.54,;-.31,-.64,;-.78,.83,;-.01,2.16,;1.18,-1.04,;1.58,-2.52,;3.07,-2.92,;3.47,-4.41,;4.16,-1.83,;5.64,-2.23,;6.73,-1.14,;8.22,-1.54,;6.33,.35,;3.76,-.35,;2.27,.05,;1.87,1.54,;-1.55,-3.08,;-.22,-3.85,;1.12,-3.08,;-.22,-5.39,;-1.55,-6.16,;-2.89,-5.39,;-2.89,-3.85,;-4.22,-3.08,;-5.55,-3.85,;-6.89,-3.08,;-8.22,-3.85,;-6.89,-1.54,;1.53,4.83,;2.3,3.49,;3.84,3.49,;4.61,4.83,;3.84,6.16,;2.3,6.16,)|
Structure:
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