Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetComplement factor D
LigandBDBM302863
Substrate/Competitorn/a
Meas. Tech.Factor D Assay
IC50 5500±n/a nM
Citation Gadhachanda, VRHashimoto, APais, GWang, QChen, DWang, XAgarwal, ADeshpande, MWiles, JAPhadke, AS Amino compounds for treatment of complement mediated disorders US Patent US9598446 Publication Date 3/21/2017
More Info.:Get all data from this article,  Assay Method
 
Complement factor D
Name:Complement factor D
Synonyms:Adipsin | C3 convertase activator | CFAD_HUMAN | CFD | DF | PFD | Properdin factor D
Type:Protein
Mol. Mass.:27039.19
Organism:Homo sapiens (Human)
Description:P00746
Residue:253
Sequence:
MHSWERLAVLVLLGAAACAAPPRGRILGGREAEAHARPYMASVQLNGAHLCGGVLVAEQW
VLSAAHCLEDAADGKVQVLLGAHSLSQPEPSKRLYDVLRAVPHPDSQPDTIDHDLLLLQL
SEKATLGPAVRPLPWQRVDRDVAPGTLCDVAGWGIVNHAGRRPDSLQHVLLPVLDRATCN
RRTHHDGAITERLMCAESNRRDSCKGDSGGPLVCGGVLEGVVTSGSRVCGNRKKPGIYTR
VASYAAWIDSVLA
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM302863
n/a
NameBDBM302863
Synonyms:(2S,4R)-1-(2-(N-(3- acetyl-1-(2-((2S,4R)- 2-(3-chloro-2- fluorobenzyl- carbamoyl)- 4-fluoropyrrolidin- 1-yl)-2-oxoethyl)-1H- indol-6- yl)methylsulfonamido) acetyl)-N-(3-chloro- 2-fluorobenzyl)-4- fluoropyrrolidine-2- carboxamide | US10660876, Cmpd No. 1 | US9598446, Compound 1
TypeSmall organic molecule
Emp. Form.C39H38Cl2F4N6O7S
Mol. Mass.881.72
SMILESCC(=O)c1cn(CC(=O)N2C[C@H](F)C[C@H]2C(=O)NCc2cccc(Cl)c2F)c2cc(ccc12)N(CC(=O)N1C[C@H](F)C[C@H]1C(=O)NCc1cccc(Cl)c1F)S(C)(=O)=O |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;HN;;;;;;;;;;;;;$|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: