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BDBM50131431 2,3-Dihydro-1H-indole-3-carboxylic acid (3S,7S)-10-oxo-8-aza-tricyclo[5.3.1.0*3,8*]undec-5-yl ester::CHEMBL319742

SMILES: O=C(OC1C[C@@H]2CC3C[C@@H](C1)N2CC3=O)C1CNc2ccccc12

InChI Key: InChIKey=AUTMMRXGMHRYPS-OSBDVLARSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50131431   
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
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50131431
PNG
(2,3-Dihydro-1H-indole-3-carboxylic acid (3S,7S)-10...)
Show SMILES O=C(OC1C[C@@H]2CC3C[C@@H](C1)N2CC3=O)C1CNc2ccccc12 |wD:9.11,5.12,TLB:14:13:5.6:9.8,12:11:3.4.10:7.6.8,(.12,-10.83,;.12,-9.28,;1.46,-8.5,;2.81,-9.27,;2.81,-10.81,;4.12,-11.58,;4.12,-10.04,;8.12,-9.28,;6.79,-8.5,;5.46,-9.27,;4.12,-8.5,;5.46,-10.81,;6.79,-11.58,;8.12,-10.83,;9.45,-11.6,;-1.21,-8.51,;-1.37,-6.97,;-2.89,-6.65,;-3.64,-7.98,;-5.14,-8.31,;-5.63,-9.77,;-4.58,-10.92,;-3.09,-10.59,;-2.61,-9.13,)|
Show InChI InChI=1S/C19H22N2O3/c22-18-10-21-12-5-11(18)6-13(21)8-14(7-12)24-19(23)16-9-20-17-4-2-1-3-15(16)17/h1-4,11-14,16,20H,5-10H2/t11?,12-,13-,14?,16?/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem
PubMed
n/an/a 5.89E+3n/an/an/an/an/an/a



Gedeon Richter Ltd

Curated by ChEMBL


Assay Description
Inhibition of human Potassium channel HERG expressed in mammalian cells


Bioorg Med Chem Lett 13: 2773-5 (2003)


BindingDB Entry DOI: 10.7270/Q2QZ2BGZ
More data for this
Ligand-Target Pair