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SMILES: OC(=O)[C@H](Cc1c[nH]c2ccc(OCCCCC3CCNCC3)cc12)NC(=O)c1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=QTADGRYGBFKDMB-VWLOTQADSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50498780   
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
Integrin beta


(Oryctolagus cuniculus)		BDBM50498780
PNG
(CHEMBL3623199)
Show SMILES OC(=O)[C@H](Cc1c[nH]c2ccc(OCCCCC3CCNCC3)cc12)NC(=O)c1ccc(cc1)[N+]([O-])=O |r|
Show InChI InChI=1S/C27H32N4O6/c32-26(19-4-6-21(7-5-19)31(35)36)30-25(27(33)34)15-20-17-29-24-9-8-22(16-23(20)24)37-14-2-1-3-18-10-12-28-13-11-18/h4-9,16-18,25,28-29H,1-3,10-15H2,(H,30,32)(H,33,34)/t25-/m0/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.88E+5n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Antagonist activity at GP2b/3a receptor in New Zealand rabbit platelet-rich plasma assessed as inhibition of ADP-induced platelet aggregation preincu...

Eur J Med Chem 102: 363-74 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.016
BindingDB Entry DOI: 10.7270/Q22J6FVM
More data for this
Ligand-Target Pair