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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Bradykinin-1 Receptor' and Ligand = 'BDBM107197'   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Bradykinin-1 Receptor


(Homo sapiens (Human))
BDBM107197
PNG
(US8592426, 47)
Show SMILES COc1ncc(cn1)C(=O)NC1(CC1)C(=O)NC1COc2cc(ccc12)-c1cc(Cl)cc(F)c1-c1noc(C)n1
Show InChI InChI=1S/C27H22ClFN6O5/c1-13-32-23(35-40-13)22-18(8-16(28)9-19(22)29)14-3-4-17-20(12-39-21(17)7-14)33-25(37)27(5-6-27)34-24(36)15-10-30-26(38-2)31-11-15/h3-4,7-11,20H,5-6,12H2,1-2H3,(H,33,37)(H,34,36)
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KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
US Patent
5.40n/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))
BDBM107197
PNG
(US8592426, 47)
Show SMILES COc1ncc(cn1)C(=O)NC1(CC1)C(=O)NC1COc2cc(ccc12)-c1cc(Cl)cc(F)c1-c1noc(C)n1
Show InChI InChI=1S/C27H22ClFN6O5/c1-13-32-23(35-40-13)22-18(8-16(28)9-19(22)29)14-3-4-17-20(12-39-21(17)7-14)33-25(37)27(5-6-27)34-24(36)15-10-30-26(38-2)31-11-15/h3-4,7-11,20H,5-6,12H2,1-2H3,(H,33,37)(H,34,36)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
US Patent
n/an/a 0.200n/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