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BDBM107208 US8592426, 58

InChI string: InChI=1S/C25H22ClFN8O3/c1-12-7-19(38-33-12)23(36)30-25(5-6-25)24(37)29-18-4-3-13-8-14(11-28-21(13)18)16-9-15(26)10-17(27)20(16)22-31-34-35(2)32-22/h7-11,18H,3-6H2,1-2H3,(H,29,37)(H,30,36)

SMILES: Cc1cc(on1)C(=O)NC1(CC1)C(=O)NC1CCc2cc(cnc12)-c1cc(Cl)cc(F)c1-c1nnn(C)n1

InChI Key: InChIKey=DNZZUJBLUHTHMB-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 = 107208   
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))
BDBM107208
PNG
(US8592426, 58)
Show SMILES Cc1cc(on1)C(=O)NC1(CC1)C(=O)NC1CCc2cc(cnc12)-c1cc(Cl)cc(F)c1-c1nnn(C)n1
Show InChI InChI=1S/C25H22ClFN8O3/c1-12-7-19(38-33-12)23(36)30-25(5-6-25)24(37)29-18-4-3-13-8-14(11-28-21(13)18)16-9-15(26)10-17(27)20(16)22-31-34-35(2)32-22/h7-11,18H,3-6H2,1-2H3,(H,29,37)(H,30,36)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
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.


US Patent US8592426 (2013)

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


(Homo sapiens (Human))
BDBM107208
PNG
(US8592426, 58)
Show SMILES Cc1cc(on1)C(=O)NC1(CC1)C(=O)NC1CCc2cc(cnc12)-c1cc(Cl)cc(F)c1-c1nnn(C)n1
Show InChI InChI=1S/C25H22ClFN8O3/c1-12-7-19(38-33-12)23(36)30-25(5-6-25)24(37)29-18-4-3-13-8-14(11-28-21(13)18)16-9-15(26)10-17(27)20(16)22-31-34-35(2)32-22/h7-11,18H,3-6H2,1-2H3,(H,29,37)(H,30,36)
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
US Patent
n/an/a 0.400n/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