BindingDB logo
myBDB logout

BDBM88539 US9695131, 48

SMILES: CCOC(=O)C(C)(C)NC(=O)c1cn(-c2ccc3n(C)c(=O)n(C)c3c2)c(=O)n(Cc2cccc(c2C)C(F)(F)F)c1=O

InChI Key: InChIKey=YLWYFQHIPBEYHJ-UHFFFAOYSA-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 = 88539   
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
Chymase


(Mesocricetus auratus (Golden hamster))
BDBM88539
PNG
(US9695131, 48)
Show SMILES CCOC(=O)C(C)(C)NC(=O)c1cn(-c2ccc3n(C)c(=O)n(C)c3c2)c(=O)n(Cc2cccc(c2C)C(F)(F)F)c1=O
Show InChI InChI=1S/C29H30F3N5O6/c1-7-43-25(40)28(3,4)33-23(38)19-15-36(18-11-12-21-22(13-18)35(6)26(41)34(21)5)27(42)37(24(19)39)14-17-9-8-10-20(16(17)2)29(30,31)32/h8-13,15H,7,14H2,1-6H3,(H,33,38)
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 54n/an/an/an/a7.5n/a



Bayer Pharma Aktiengesellschaft

US Patent


Assay Description
The enzyme source used is recombinant human chymase (expressed in HEK293 cells) or chymase purified from hamsters' tongues. The substrate used for ch...


US Patent US9695131 (2017)


BindingDB Entry DOI: 10.7270/Q2ZP448Z
More data for this
Ligand-Target Pair