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BDBM107196 US8592426, 46

SMILES: Cc1nc(no1)-c1c(F)cc(Cl)cc1-c1ccc2C(COc2c1)NC(=O)C1(CC1)NC(=O)c1ccnnc1

InChI Key: InChIKey=UFPMXLUTBQTILN-UHFFFAOYSA-N

Data: 1 KI  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 2 hits for monomerid = 107196   
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
Kininogen-1


(Homo sapiens (Human))
BDBM107196
PNG
(US8592426, 46)
Show SMILES Cc1nc(no1)-c1c(F)cc(Cl)cc1-c1ccc2C(COc2c1)NC(=O)C1(CC1)NC(=O)c1ccnnc1
Show InChI InChI=1S/C26H20ClFN6O4/c1-13-31-23(34-38-13)22-18(9-16(27)10-19(22)28)14-2-3-17-20(12-37-21(17)8-14)32-25(36)26(5-6-26)33-24(35)15-4-7-29-30-11-15/h2-4,7-11,20H,5-6,12H2,1H3,(H,32,36)(H,33,35)
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KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
19.1n/an/an/an/an/an/an/an/a



Hoffmann—La Roche Inc.

US Patent


Assay Description
Binding assay using Bradykinin-1 receptor.


US Patent US8592426 (2013)


BindingDB Entry DOI: 10.7270/Q2WH2NN0
More data for this
Ligand-Target Pair
Kininogen-1


(Homo sapiens (Human))
BDBM107196
PNG
(US8592426, 46)
Show SMILES Cc1nc(no1)-c1c(F)cc(Cl)cc1-c1ccc2C(COc2c1)NC(=O)C1(CC1)NC(=O)c1ccnnc1
Show InChI InChI=1S/C26H20ClFN6O4/c1-13-31-23(34-38-13)22-18(9-16(27)10-19(22)28)14-2-3-17-20(12-37-21(17)8-14)32-25(36)26(5-6-26)33-24(35)15-4-7-29-30-11-15/h2-4,7-11,20H,5-6,12H2,1H3,(H,32,36)(H,33,35)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 4.70n/an/an/an/an/an/a



Hoffmann—La Roche Inc.

US Patent


Assay Description
Calcium mobilization assay using Bradykinin-1 receptor.


US Patent US8592426 (2013)


BindingDB Entry DOI: 10.7270/Q2WH2NN0
More data for this
Ligand-Target Pair