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BDBM50192824 CHEMBL3924665

SMILES: Cc1nc(C)c(s1)-c1csc(Nc2ccc(cn2)C(=O)N2[C@H]3CC[C@@H]2C[C@@H](C3)Oc2ncc(cn2)C(F)(F)F)n1

InChI Key: InChIKey=OBVMFWNMVDHVPD-BWTSREIZSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50192824   
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
Vanilloid receptor


(Rattus norvegicus)
BDBM50192824
PNG
(CHEMBL3924665)
Show SMILES Cc1nc(C)c(s1)-c1csc(Nc2ccc(cn2)C(=O)N2[C@H]3CC[C@@H]2C[C@@H](C3)Oc2ncc(cn2)C(F)(F)F)n1 |r|
Show InChI InChI=1S/C26H24F3N7O2S2/c1-13-22(40-14(2)33-13)20-12-39-25(34-20)35-21-6-3-15(9-30-21)23(37)36-17-4-5-18(36)8-19(7-17)38-24-31-10-16(11-32-24)26(27,28)29/h3,6,9-12,17-19H,4-5,7-8H2,1-2H3,(H,30,34,35)/t17-,18+,19+
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 120n/an/an/an/an/an/a



Shionogi& Co., Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at rat TRPV4 assessed as inhibition of 4alpha-PDD-induced activation


Bioorg Med Chem Lett 26: 4936-4941 (2016)


Article DOI: 10.1016/j.bmcl.2016.09.014
BindingDB Entry DOI: 10.7270/Q2154K06
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 4


(Homo sapiens (Human))
BDBM50192824
PNG
(CHEMBL3924665)
Show SMILES Cc1nc(C)c(s1)-c1csc(Nc2ccc(cn2)C(=O)N2[C@H]3CC[C@@H]2C[C@@H](C3)Oc2ncc(cn2)C(F)(F)F)n1 |r|
Show InChI InChI=1S/C26H24F3N7O2S2/c1-13-22(40-14(2)33-13)20-12-39-25(34-20)35-21-6-3-15(9-30-21)23(37)36-17-4-5-18(36)8-19(7-17)38-24-31-10-16(11-32-24)26(27,28)29/h3,6,9-12,17-19H,4-5,7-8H2,1-2H3,(H,30,34,35)/t17-,18+,19+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.80n/an/an/an/an/an/a



Shionogi& Co., Ltd

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV4 assessed as inhibition of 4alpha-PDD-induced activation


Bioorg Med Chem Lett 26: 4936-4941 (2016)


Article DOI: 10.1016/j.bmcl.2016.09.014
BindingDB Entry DOI: 10.7270/Q2154K06
More data for this
Ligand-Target Pair