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BDBM76100 3-[[[1-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-2-methyl-propyl]-(2-hydroxyethyl)amino]methyl]-6-ethoxy-1H-quinolin-2-one::3-[[[1-(1-cyclohexyl-5-tetrazolyl)-2-methylpropyl]-(2-hydroxyethyl)amino]methyl]-6-ethoxy-1H-quinolin-2-one::3-[[[1-(1-cyclohexyltetrazol-5-yl)-2-methyl-propyl]-(2-hydroxyethyl)amino]methyl]-6-ethoxy-carbostyril::3-[[[1-(1-cyclohexyltetrazol-5-yl)-2-methylpropyl]-(2-hydroxyethyl)amino]methyl]-6-ethoxy-1H-quinolin-2-one::3-{[[1-(1-Cyclohexyl-1H-tetrazol-5-yl)-2-methyl-propyl]-(2-hydroxy-ethyl)-amino]-methyl}-6-ethoxy-1H-quinolin-2-one::MLS000072982::SMR000004541::cid_646961

SMILES: CCOc1ccc2[nH]c(=O)c(CN(CCO)C(C(C)C)c3nnnn3C3CCCCC3)cc2c1

InChI Key: InChIKey=VNOPZJDLFPFULN-UHFFFAOYSA-N

Data: 2 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 76100   
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
Apelin receptor


(Homo sapiens (Human))
BDBM76100
PNG
(3-[[[1-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-2-meth...)
Show SMILES CCOc1ccc2[nH]c(=O)c(CN(CCO)C(C(C)C)c3nnnn3C3CCCCC3)cc2c1
Show InChI InChI=1S/C25H36N6O3/c1-4-34-21-10-11-22-18(15-21)14-19(25(33)26-22)16-30(12-13-32)23(17(2)3)24-27-28-29-31(24)20-8-6-5-7-9-20/h10-11,14-15,17,20,23,32H,4-9,12-13,16H2,1-3H3,(H,26,33)
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PC cid
PC sid
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Similars

Article
PCBioAssay
n/an/an/an/a>1.00E+5n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego) Ne...


PubChem Bioassay (2010)


Article DOI: 10.1016/j.carres.2010.10.023
BindingDB Entry DOI: 10.7270/Q2NV9GP9
More data for this
Ligand-Target Pair
Angiotensin II receptor


(Homo sapiens (Human))
BDBM76100
PNG
(3-[[[1-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)-2-meth...)
Show SMILES CCOc1ccc2[nH]c(=O)c(CN(CCO)C(C(C)C)c3nnnn3C3CCCCC3)cc2c1
Show InChI InChI=1S/C25H36N6O3/c1-4-34-21-10-11-22-18(15-21)14-19(25(33)26-22)16-30(12-13-32)23(17(2)3)24-27-28-29-31(24)20-8-6-5-7-9-20/h10-11,14-15,17,20,23,32H,4-9,12-13,16H2,1-3H3,(H,26,33)
PDB

Reactome pathway
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UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>1.00E+5n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego) Ne...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2PR7TFT
More data for this
Ligand-Target Pair