Reaction Details Report a problem with these data
Target
Complement factor D
Ligand
BDBM511728
Substrate
n/a
Meas. Tech.
Factor D Assay
IC50
<1000±n/a nM
Citation
Wiles, JA; Phadke, AS; Deshpande, M; Agarwal, A; Chen, D; Gadhachanda, VR; Hashimoto, A; Pais, G; Wang, Q; Wang, X; Barrish, JC; Greenlee, W; Eastman, KJ Aryl, heteroaryl, and heterocyclic pharmaceutical compounds for treatment of medical disorders US Patent US11084800 Publication Date 8/10/2021
More Info.:
Target
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:
MHSWERLAVLVLLGAAACAAPPRGRILGGREAEAHARPYMASVQLNGAHLCGGVLVAEQWVLSAAHCLEDAADGKVQVLLGAHSLSQPEPSKRLYDVLRAVPHPDSQPDTIDHDLLLLQLSEKATLGPAVRPLPWQRVDRDVAPGTLCDVAGWGIVNHAGRRPDSLQHVLLPVLDRATCNRRTHHDGAITERLMCAESNRRDSCKGDSGGPLVCGGVLEGVVTSGSRVCGNRKKPGIYTRVASYAAWIDSVLA
Inhibitor
Name:
BDBM511728
Synonyms:
(1R,3S,5R)-2-(2-(3-acetyl-7-methyl-5-(2- methylpyrimidin-5-yl)-1H-indazol-1- yl)acetyl)-N-((S)-3-fluoro-4-methylpent-3-en- 2-yl)-5-methyl-2-azabicyclo[3.1.0]hexane-3- carboxamide | US11084800, Cpd No. 34 | US11708351, Compound 34
Type:
Small organic molecule
Emp. Form.:
C30H35FN6O3
Mol. Mass.:
546.6357
SMILES:
[#6]-[#6@H](-[#7]-[#6](=O)-[#6@@H]-1-[#6][C@@]2([#6])[#6]-[#6@H]2-[#7]-1-[#6](=O)-[#6]-n1nc(-[#6](-[#6])=O)c2cc(cc(-[#6])c12)-c1cnc(-[#6])nc1)-[#6](\F)=[#6](/[#6])-[#6] |r|