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BDBM50079763 7-(4-Isopropyl-benzyl)-N*1*,N*3*,N*3*-trimethyl-7H-pyrrolo[3,2-f]quinazoline-1,3-diamine::CHEMBL303084

SMILES: CNc1nc(nc2ccc3n(Cc4ccc(cc4)C(C)C)ccc3c12)N(C)C

InChI Key: InChIKey=WRGIOZQVFSODHP-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50079763   
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
Proteinase-activated receptor 1


(Homo sapiens (Human))
BDBM50079763
PNG
(7-(4-Isopropyl-benzyl)-N*1*,N*3*,N*3*-trimethyl-7H...)
Show SMILES CNc1nc(nc2ccc3n(Cc4ccc(cc4)C(C)C)ccc3c12)N(C)C
Show InChI InChI=1S/C23H27N5/c1-15(2)17-8-6-16(7-9-17)14-28-13-12-18-20(28)11-10-19-21(18)22(24-3)26-23(25-19)27(4)5/h6-13,15H,14H2,1-5H3,(H,24,25,26)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 3.20E+3n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against binding to Thrombin receptor 1 (PAR-1)


Bioorg Med Chem Lett 9: 2073-8 (1999)


BindingDB Entry DOI: 10.7270/Q25X284B
More data for this
Ligand-Target Pair