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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 = 'BDBM107194'   
Target/Host
(Institution)
LigandTarget/Host
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))
BDBM107194
PNG
(US8592426, 43)
Show SMILES Cc1nc(no1)-c1c(F)cc(Cl)cc1-c1cnc2C(CCc2c1)NC(=O)C1(CC1)NC(=O)c1ccno1
Show InChI InChI=1S/C25H20ClFN6O4/c1-12-30-22(33-36-12)20-16(9-15(26)10-17(20)27)14-8-13-2-3-18(21(13)28-11-14)31-24(35)25(5-6-25)32-23(34)19-4-7-29-37-19/h4,7-11,18H,2-3,5-6H2,1H3,(H,31,35)(H,32,34)
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KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
6.30n/an/an/an/an/an/an/an/a



Hoffmann—La Roche Inc.

US Patent


Assay Description
Binding assay using Bradykinin-1 receptor.


Citation and Details
More data for this
Ligand-Target Pair
Bradykinin-1 Receptor


(Homo sapiens (Human))
BDBM107194
PNG
(US8592426, 43)
Show SMILES Cc1nc(no1)-c1c(F)cc(Cl)cc1-c1cnc2C(CCc2c1)NC(=O)C1(CC1)NC(=O)c1ccno1
Show InChI InChI=1S/C25H20ClFN6O4/c1-12-30-22(33-36-12)20-16(9-15(26)10-17(20)27)14-8-13-2-3-18(21(13)28-11-14)31-24(35)25(5-6-25)32-23(34)19-4-7-29-37-19/h4,7-11,18H,2-3,5-6H2,1H3,(H,31,35)(H,32,34)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 0.300n/an/an/an/an/an/a



Hoffmann—La Roche Inc.

US Patent


Assay Description
Calcium mobilization assay using Bradykinin-1 receptor.


Citation and Details
More data for this
Ligand-Target Pair