BindingDB logo
myBDB logout

BDBM50192777 CHEMBL3915675

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

InChI Key: InChIKey=MHVSNYZARVQBHO-PIIMJCKOSA-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 = 50192777   
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
Transient receptor potential cation channel subfamily V member 4


(Homo sapiens (Human))
BDBM50192777
PNG
(CHEMBL3915675)
Show SMILES Cc1nc(C)c(s1)-c1csc(Nc2ccc(cn2)C(=O)N2[C@H]3CC[C@@H]2C[C@@H](C3)OC(=O)NCCF)n1 |r|
Show InChI InChI=1S/C24H27FN6O3S2/c1-13-21(36-14(2)28-13)19-12-35-23(29-19)30-20-6-3-15(11-27-20)22(32)31-16-4-5-17(31)10-18(9-16)34-24(33)26-8-7-25/h3,6,11-12,16-18H,4-5,7-10H2,1-2H3,(H,26,33)(H,27,29,30)/t16-,17+,18+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 6.70n/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
Transient receptor potential cation channel subfamily V member 4


(Rattus norvegicus)
BDBM50192777
PNG
(CHEMBL3915675)
Show SMILES Cc1nc(C)c(s1)-c1csc(Nc2ccc(cn2)C(=O)N2[C@H]3CC[C@@H]2C[C@@H](C3)OC(=O)NCCF)n1 |r|
Show InChI InChI=1S/C24H27FN6O3S2/c1-13-21(36-14(2)28-13)19-12-35-23(29-19)30-20-6-3-15(11-27-20)22(32)31-16-4-5-17(31)10-18(9-16)34-24(33)26-8-7-25/h3,6,11-12,16-18H,4-5,7-10H2,1-2H3,(H,26,33)(H,27,29,30)/t16-,17+,18+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 290n/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