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BDBM107154 US8592426, 3

InChI string: InChI=1S/C23H20ClF3N2O4/c1-33-19(30)18-15(3-2-4-16(18)24)13-5-7-14-12(11-13)6-8-17(14)28-20(31)22(9-10-22)29-21(32)23(25,26)27/h2-5,7,11,17H,6,8-10H2,1H3,(H,28,31)(H,29,32)

SMILES: COC(=O)c1c(Cl)cccc1-c1ccc2C(CCc2c1)NC(=O)C1(CC1)NC(=O)C(F)(F)F

InChI Key: InChIKey=MBIKZIVONJGCJQ-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 = 107154   
Target
(Institution)
LigandTarget
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
Bradykinin-1 Receptor


(Homo sapiens (Human))
BDBM107154
PNG
(US8592426, 3)
Show SMILES COC(=O)c1c(Cl)cccc1-c1ccc2C(CCc2c1)NC(=O)C1(CC1)NC(=O)C(F)(F)F
Show InChI InChI=1S/C23H20ClF3N2O4/c1-33-19(30)18-15(3-2-4-16(18)24)13-5-7-14-12(11-13)6-8-17(14)28-20(31)22(9-10-22)29-21(32)23(25,26)27/h2-5,7,11,17H,6,8-10H2,1H3,(H,28,31)(H,29,32)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
US Patent
123n/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)

More data for this
Ligand-Target Pair
Bradykinin-1 Receptor


(Homo sapiens (Human))
BDBM107154
PNG
(US8592426, 3)
Show SMILES COC(=O)c1c(Cl)cccc1-c1ccc2C(CCc2c1)NC(=O)C1(CC1)NC(=O)C(F)(F)F
Show InChI InChI=1S/C23H20ClF3N2O4/c1-33-19(30)18-15(3-2-4-16(18)24)13-5-7-14-12(11-13)6-8-17(14)28-20(31)22(9-10-22)29-21(32)23(25,26)27/h2-5,7,11,17H,6,8-10H2,1H3,(H,28,31)(H,29,32)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
US Patent
n/an/a 47.4n/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)

More data for this
Ligand-Target Pair