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BDBM340286 (2S,4R)-1-(2-(3-acetyl- 1H-indol-1-yl)acetyl)- N-(2'-chloro-2,3',5'- trifluorobiphenyl-3-yl)- 4-fluoropyrrolidine-2- carboxamide::US9758537, Compound 95

SMILES: CC(=O)c1cn(CC(=O)N2C[C@H](F)C[C@H]2C(=O)Nc2cccc(c2F)-c2cc(F)cc(F)c2Cl)c2ccccc12

InChI Key: InChIKey=XEMZMQZSGVKSFA-NSYGIPOTSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 340286   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Factor D


(Homo sapiens (Human))
BDBM340286
PNG
((2S,4R)-1-(2-(3-acetyl- 1H-indol-1-yl)acetyl)- N-(...)
Show SMILES CC(=O)c1cn(CC(=O)N2C[C@H](F)C[C@H]2C(=O)Nc2cccc(c2F)-c2cc(F)cc(F)c2Cl)c2ccccc12
Show InChI InChI=1S/C29H22ClF4N3O3/c1-15(38)21-13-36(24-8-3-2-5-18(21)24)14-26(39)37-12-17(32)11-25(37)29(40)35-23-7-4-6-19(28(23)34)20-9-16(31)10-22(33)27(20)30/h2-10,13,17,25H,11-12,14H2,1H3,(H,35,40)/t17-,25+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals

US Patent


Assay Description
Human factor D (purified from human serum, Complement Technology, Inc.) at 80 nM final concentration is incubated with test compound at various conce...


US Patent US9758537 (2017)

More data for this
Ligand-Target Pair