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BDBM176548 US9120756, 6

SMILES: CCCCCCn1nc(cc1CNC(=O)[C@@H](C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C

InChI Key: InChIKey=BXCIEPTXZCCLIC-KRWDZBQOSA-N

Data: 2 KI

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 = 176548   
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 1


(Rattus norvegicus (rat))
BDBM176548
PNG
(US9120756, 6)
Show SMILES CCCCCCn1nc(cc1CNC(=O)[C@@H](C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C24H37FN4O3S/c1-7-8-9-10-13-29-19(15-22(27-29)24(3,4)5)16-26-23(30)17(2)18-11-12-21(20(25)14-18)28-33(6,31)32/h11-12,14-15,17,28H,7-10,13,16H2,1-6H3,(H,26,30)/t17-/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

US Patent
14.5n/an/an/an/an/an/an/an/a



Gruenenthal GmbH

US Patent


Assay Description
The agonistic or antagonistic effect of the substances to be tested on the rat-species vanilloid receptor 1 (VR1/TRPV1) can be determined using the f...


US Patent US9120756 (2015)


BindingDB Entry DOI: 10.7270/Q26D5RRG
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM176548
PNG
(US9120756, 6)
Show SMILES CCCCCCn1nc(cc1CNC(=O)[C@@H](C)c1ccc(NS(C)(=O)=O)c(F)c1)C(C)(C)C
Show InChI InChI=1S/C24H37FN4O3S/c1-7-8-9-10-13-29-19(15-22(27-29)24(3,4)5)16-26-23(30)17(2)18-11-12-21(20(25)14-18)28-33(6,31)32/h11-12,14-15,17,28H,7-10,13,16H2,1-6H3,(H,26,30)/t17-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

US Patent
27.7 -10.7n/an/an/an/an/an/a37



Gruenenthal GmbH

US Patent


Assay Description
The agonistic or antagonistic effect of the substances to be tested on the vanilloid receptor 1 (VR1) can also be determined using the following assa...


US Patent US9120756 (2015)


BindingDB Entry DOI: 10.7270/Q26D5RRG
More data for this
Ligand-Target Pair