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BDBM50241330 CHEMBL398829::N-(4-(2-((1-isobutylpiperidin-4-yl)methylamino)-6-(4-(trifluoromethyl)phenyl)pyrimidin-4-yloxy)benzo[d]thiazol-2-yl)acetamide

SMILES: CC(C)CN1CCC(CNc2nc(Oc3cccc4sc(NC(C)=O)nc34)cc(n2)-c2ccc(cc2)C(F)(F)F)CC1

InChI Key: InChIKey=WWYOJWMTSUQDTO-UHFFFAOYSA-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 = 50241330   
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 (rat))
BDBM50241330
PNG
(CHEMBL398829 | N-(4-(2-((1-isobutylpiperidin-4-yl)...)
Show SMILES CC(C)CN1CCC(CNc2nc(Oc3cccc4sc(NC(C)=O)nc34)cc(n2)-c2ccc(cc2)C(F)(F)F)CC1
Show InChI InChI=1S/C30H33F3N6O2S/c1-18(2)17-39-13-11-20(12-14-39)16-34-28-36-23(21-7-9-22(10-8-21)30(31,32)33)15-26(37-28)41-24-5-4-6-25-27(24)38-29(42-25)35-19(3)40/h4-10,15,18,20H,11-14,16-17H2,1-3H3,(H,34,36,37)(H,35,38,40)
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CHEMBL
PC cid
PC sid
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Similars

Article
PubMed
n/an/a 51n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at rat TRPV1 expressed in CHO cells assessed inhibition of capsaicin induced calcium influx


Bioorg Med Chem Lett 17: 6539-45 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.080
BindingDB Entry DOI: 10.7270/Q2FX7961
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50241330
PNG
(CHEMBL398829 | N-(4-(2-((1-isobutylpiperidin-4-yl)...)
Show SMILES CC(C)CN1CCC(CNc2nc(Oc3cccc4sc(NC(C)=O)nc34)cc(n2)-c2ccc(cc2)C(F)(F)F)CC1
Show InChI InChI=1S/C30H33F3N6O2S/c1-18(2)17-39-13-11-20(12-14-39)16-34-28-36-23(21-7-9-22(10-8-21)30(31,32)33)15-26(37-28)41-24-5-4-6-25-27(24)38-29(42-25)35-19(3)40/h4-10,15,18,20H,11-14,16-17H2,1-3H3,(H,34,36,37)(H,35,38,40)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 64n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at rat TRPV1 expressed in CHO cells assessed inhibition of acid induced calcium influx


Bioorg Med Chem Lett 17: 6539-45 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.080
BindingDB Entry DOI: 10.7270/Q2FX7961
More data for this
Ligand-Target Pair