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BDBM50113944 CHEMBL3605005

SMILES:

InChI Key: InChIKey=VATRZDWMOKJFRC-AGBDBUHGSA-N

Data: 2 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 2 hits for monomerid = 50113944   
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))
BDBM50113944
PNG
(CHEMBL3605005)
Show InChI InChI=1S/C30H32FN5O6/c31-21-13-32-22-2-4-25(41-14-17-11-20(17)28(38)39)36-26(22)19(21)5-6-30-9-7-29(8-10-30,16-42-30)33-12-18-1-3-23-27(34-18)35-24(37)15-40-23/h1-4,13,17,20,33H,5-12,14-16H2,(H,38,39)(H,34,35,37)/t17-,20+,29?,30?/m1/s1
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PC cid
PC sid
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Similars

PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in CHO cells by patch express method based electrophysiology assay


Bioorg Med Chem Lett 25: 3630-5 (2015)


BindingDB Entry DOI: 10.7270/Q2M0477R
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50113944
PNG
(CHEMBL3605005)
Show InChI InChI=1S/C30H32FN5O6/c31-21-13-32-22-2-4-25(41-14-17-11-20(17)28(38)39)36-26(22)19(21)5-6-30-9-7-29(8-10-30,16-42-30)33-12-18-1-3-23-27(34-18)35-24(37)15-40-23/h1-4,13,17,20,33H,5-12,14-16H2,(H,38,39)(H,34,35,37)/t17-,20+,29?,30?/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 4.34E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human ERG assessed as reduction in MK499 competitive binding


Bioorg Med Chem Lett 25: 3630-5 (2015)


BindingDB Entry DOI: 10.7270/Q2M0477R
More data for this
Ligand-Target Pair