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BDBM50172537 (3-Amino-propyl)-[2-(4-butylamino-benzoyloxy)-ethyl]-dimethyl-ammonium::CHEMBL196995

SMILES: CCCCNc1ccc(cc1)C(=O)OCC[N+](C)(C)CCC[NH3+]

InChI Key: InChIKey=QXDCQICQQSQQFK-UHFFFAOYSA-P

Data: 2 Kd

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 = 50172537   
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
cGMP-gated cation channel alpha 1


(Bos taurus)
BDBM50172537
PNG
((3-Amino-propyl)-[2-(4-butylamino-benzoyloxy)-ethy...)
Show SMILES CCCCNc1ccc(cc1)C(=O)OCC[N+](C)(C)CCC[NH3+]
Show InChI InChI=1S/C18H31N3O2/c1-4-5-12-20-17-9-7-16(8-10-17)18(22)23-15-14-21(2,3)13-6-11-19/h7-10H,4-6,11-15,19H2,1-3H3/p+2
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 1.40E+3n/an/an/an/an/a



Oregon Health and Science University

Curated by ChEMBL


Assay Description
Apparent dissociation constant against Cyclic nucleotide gated channel alpha 1 at 0 mV


J Med Chem 48: 5805-12 (2005)


Article DOI: 10.1021/jm0502485
BindingDB Entry DOI: 10.7270/Q2BC40BH
More data for this
Ligand-Target Pair
cGMP-gated cation channel alpha 1


(Bos taurus)
BDBM50172537
PNG
((3-Amino-propyl)-[2-(4-butylamino-benzoyloxy)-ethy...)
Show SMILES CCCCNc1ccc(cc1)C(=O)OCC[N+](C)(C)CCC[NH3+]
Show InChI InChI=1S/C18H31N3O2/c1-4-5-12-20-17-9-7-16(8-10-17)18(22)23-15-14-21(2,3)13-6-11-19/h7-10H,4-6,11-15,19H2,1-3H3/p+2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 74n/an/an/an/an/a



Oregon Health and Science University

Curated by ChEMBL


Assay Description
Apparent dissociation constant against Cyclic nucleotide gated channel alpha 1 at +40 mV


J Med Chem 48: 5805-12 (2005)


Article DOI: 10.1021/jm0502485
BindingDB Entry DOI: 10.7270/Q2BC40BH
More data for this
Ligand-Target Pair