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BDBM50000943 7-[4-(1H-Tetrazol-5-yl)-butoxy]-1,3-dihydro-imidazo[4,5-b]quinolin-2-one::CHEMBL90120

SMILES: O=c1[nH]c2cc3cc(OCCCCc4nnn[nH]4)ccc3nc2[nH]1

InChI Key: InChIKey=CNYZQAJGKTXFPB-UHFFFAOYSA-N

Data: 1 IC50  2 EC50

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 3 hits for monomerid = 50000943   
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
Purinergic receptor P2Y12


(Homo sapiens (Human))
BDBM50000943
PNG
(7-[4-(1H-Tetrazol-5-yl)-butoxy]-1,3-dihydro-imidaz...)
Show SMILES O=c1[nH]c2cc3cc(OCCCCc4nnn[nH]4)ccc3nc2[nH]1
Show InChI InChI=1S/C15H15N7O2/c23-15-17-12-8-9-7-10(4-5-11(9)16-14(12)18-15)24-6-2-1-3-13-19-21-22-20-13/h4-5,7-8H,1-3,6H2,(H2,16,17,18,23)(H,19,20,21,22)
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PC cid
PC sid
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PubMed
n/an/an/an/a 5.40E+3n/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of platelet aggregation using Adenosine diphosphate (ADP) as activating agent in rabbit platelet rich plasma (PRP)


J Med Chem 35: 2672-87 (1992)


BindingDB Entry DOI: 10.7270/Q2513X52
More data for this
Ligand-Target Pair
Phosphodiesterase 3


(Homo sapiens (Human))
BDBM50000943
PNG
(7-[4-(1H-Tetrazol-5-yl)-butoxy]-1,3-dihydro-imidaz...)
Show SMILES O=c1[nH]c2cc3cc(OCCCCc4nnn[nH]4)ccc3nc2[nH]1
Show InChI InChI=1S/C15H15N7O2/c23-15-17-12-8-9-7-10(4-5-11(9)16-14(12)18-15)24-6-2-1-3-13-19-21-22-20-13/h4-5,7-8H,1-3,6H2,(H2,16,17,18,23)(H,19,20,21,22)
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MMDB

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antibodypedia
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PC cid
PC sid
UniChem

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PubMed
n/an/a 10n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human platelet PDE by inhibiting cyclic Adenosine monophosphate (cAMP) hydrolysis


J Med Chem 35: 2672-87 (1992)


BindingDB Entry DOI: 10.7270/Q2513X52
More data for this
Ligand-Target Pair
Purinergic receptor P2Y12


(Homo sapiens (Human))
BDBM50000943
PNG
(7-[4-(1H-Tetrazol-5-yl)-butoxy]-1,3-dihydro-imidaz...)
Show SMILES O=c1[nH]c2cc3cc(OCCCCc4nnn[nH]4)ccc3nc2[nH]1
Show InChI InChI=1S/C15H15N7O2/c23-15-17-12-8-9-7-10(4-5-11(9)16-14(12)18-15)24-6-2-1-3-13-19-21-22-20-13/h4-5,7-8H,1-3,6H2,(H2,16,17,18,23)(H,19,20,21,22)
PDB

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UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem

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PubMed
n/an/an/an/a 5.10E+4n/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of platelet aggregation using adenosine diphosphate (ADP) as activating agent in human platelet rich plasma (PRP)


J Med Chem 35: 2672-87 (1992)


BindingDB Entry DOI: 10.7270/Q2513X52
More data for this
Ligand-Target Pair