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BDBM50209731 (R)-N-((R)-7-((cyclobutylamino)methyl)chroman-4-yl)-3-(4-fluorophenyl)-3-(3-(trifluoromethyl)phenylsulfonamido)-propanamide::CHEMBL227977

SMILES: Fc1ccc(cc1)[C@@H](CC(=O)N[C@@H]1CCOc2cc(CNC3CCC3)ccc12)NS(=O)(=O)c1cccc(c1)C(F)(F)F

InChI Key: InChIKey=NSDUYSBJPXNBES-KAYWLYCHSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50209731   
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
Bradykinin B1 receptor


(Homo sapiens (Human))
BDBM50209731
PNG
((R)-N-((R)-7-((cyclobutylamino)methyl)chroman-4-yl...)
Show SMILES Fc1ccc(cc1)[C@@H](CC(=O)N[C@@H]1CCOc2cc(CNC3CCC3)ccc12)NS(=O)(=O)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C30H31F4N3O4S/c31-22-10-8-20(9-11-22)27(37-42(39,40)24-6-1-3-21(16-24)30(32,33)34)17-29(38)36-26-13-14-41-28-15-19(7-12-25(26)28)18-35-23-4-2-5-23/h1,3,6-12,15-16,23,26-27,35,37H,2,4-5,13-14,17-18H2,(H,36,38)/t26-,27-/m1/s1
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
10n/an/an/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]DAK from human bradykinin B1 receptor expressed in CHOD cells


J Med Chem 50: 2200-12 (2007)


Article DOI: 10.1021/jm070055c
BindingDB Entry DOI: 10.7270/Q2MS3SG2
More data for this
Ligand-Target Pair
Bradykinin B1 receptor


(Homo sapiens (Human))
BDBM50209731
PNG
((R)-N-((R)-7-((cyclobutylamino)methyl)chroman-4-yl...)
Show SMILES Fc1ccc(cc1)[C@@H](CC(=O)N[C@@H]1CCOc2cc(CNC3CCC3)ccc12)NS(=O)(=O)c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C30H31F4N3O4S/c31-22-10-8-20(9-11-22)27(37-42(39,40)24-6-1-3-21(16-24)30(32,33)34)17-29(38)36-26-13-14-41-28-15-19(7-12-25(26)28)18-35-23-4-2-5-23/h1,3,6-12,15-16,23,26-27,35,37H,2,4-5,13-14,17-18H2,(H,36,38)/t26-,27-/m1/s1
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 46.2n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human bradykinin B1 receptor expressed in CHOD cellsassessed as effect on DAK-induced calcium flux


J Med Chem 50: 2200-12 (2007)


Article DOI: 10.1021/jm070055c
BindingDB Entry DOI: 10.7270/Q2MS3SG2
More data for this
Ligand-Target Pair