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BDBM235955 US9365539, 36

SMILES: OC(CN1CCC(CC1)c1cc(nn1-c1ncccn1)-c1ccc(Cl)cc1)c1ccccc1

InChI Key: InChIKey=VSNXVFRRZXFFLD-UHFFFAOYNA-N

Data: 1 IC50

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 1 hit for monomerid = 235955   
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
Prolylcarboxypeptidase (PRCP)


(Homo sapiens (Human))
BDBM235955
PNG
(US9365539, 36)
Show SMILES OC(CN1CCC(CC1)c1cc(nn1-c1ncccn1)-c1ccc(Cl)cc1)c1ccccc1
Show InChI InChI=1/C26H26ClN5O/c27-22-9-7-19(8-10-22)23-17-24(32(30-23)26-28-13-4-14-29-26)20-11-15-31(16-12-20)18-25(33)21-5-2-1-3-6-21/h1-10,13-14,17,20,25,33H,11-12,15-16,18H2
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/a 0.310n/an/an/an/a5.5n/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The assay was run in a 384-well microliter plate at 37 C. with a total volume of 50 uL. Final assay concentrations were 0.13 nM human PrCP (CHO) or ...


US Patent US9365539 (2016)


BindingDB Entry DOI: 10.7270/Q22B8WXK
More data for this
Ligand-Target Pair