Reaction Details Report a problem with these data
Target
C5a anaphylatoxin chemotactic receptor 1
Ligand
BDBM577806
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:
BDBM577806
Synonyms:
US11478460, Compound 1.146
Type:
Small organic molecule
Emp. Form.:
C30H31F2N5O
Mol. Mass.:
515.5968
SMILES:
Cc1cccc(C)c1-n1nc2CCN(Cc2c1-c1cc(F)c(NC(N)=O)cc1F)C(C)(C)c1ccccc1 |(-6.22,-3.16,;-4.89,-3.93,;-4.89,-5.47,;-3.55,-6.24,;-2.22,-5.47,;-2.22,-3.93,;-.89,-3.16,;-3.55,-3.16,;-3.55,-1.62,;-4.8,-.71,;-4.32,.75,;-5.09,2.08,;-4.32,3.42,;-2.78,3.42,;-2.01,2.08,;-2.78,.75,;-2.31,-.71,;-.82,-1.11,;-.42,-2.6,;1.07,-3,;1.47,-4.49,;2.16,-1.91,;3.64,-2.31,;4.73,-1.22,;6.22,-1.62,;4.33,.27,;1.76,-.42,;.27,-.02,;-.13,1.46,;-2.01,4.75,;-3.1,5.84,;-1.61,6.24,;-.47,4.75,;.3,3.42,;1.84,3.42,;2.61,4.75,;1.84,6.09,;.3,6.09,)|
Structure:
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