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Patent code US9481685

Compile Data Set for Download or QSAR
Found 8 hits of Enzyme Inhibition Constant Data   
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
Translocator protein


(Rattus norvegicus (rat))		BDBM253021
PNG
(US9481685, 4)
Show SMILES CCN(CC)C(=O)C1Sc2c(F)cccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C22H22F2N2OS/c1-3-25(4-2)22(27)21-18-14-8-5-6-11-17(14)26(13-12-23)19(18)15-9-7-10-16(24)20(15)28-21/h5-11,21H,3-4,12-13H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 0.310n/an/an/an/an/an/a7.4n/a



GE Healthcare Limited

US Patent


Assay Description
The compounds were screened for their affinity for PBR using a method adapted from Le Fur et al (Life Sci. 1983; USA 33: 449-57).The compounds to be ...

US Patent US9481685 (2016)


BindingDB Entry DOI: 10.7270/Q25M64NT
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))		BDBM253022
PNG
(US9481685, 5)
Show SMILES CCN(CC)C(=O)C1Sc2cc(F)ccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C22H22F2N2OS/c1-3-25(4-2)22(27)21-19-15-7-5-6-8-17(15)26(12-11-23)20(19)16-10-9-14(24)13-18(16)28-21/h5-10,13,21H,3-4,11-12H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 0.320n/an/an/an/an/an/a7.4n/a



GE Healthcare Limited

US Patent


Assay Description
The compounds were screened for their affinity for PBR using a method adapted from Le Fur et al (Life Sci. 1983; USA 33: 449-57).The compounds to be ...

US Patent US9481685 (2016)


BindingDB Entry DOI: 10.7270/Q25M64NT
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))		BDBM253019
PNG
(US9481685, 1)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1cc(OC)ccc1n2CCF
Show InChI InChI=1S/C23H25FN2O2S/c1-4-25(5-2)23(27)22-20-17-14-15(28-3)10-11-18(17)26(13-12-24)21(20)16-8-6-7-9-19(16)29-22/h6-11,14,22H,4-5,12-13H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 0.370n/an/an/an/an/an/a7.4n/a



GE Healthcare Limited

US Patent


Assay Description
The compounds were screened for their affinity for PBR using a method adapted from Le Fur et al (Life Sci. 1983; USA 33: 449-57).The compounds to be ...

US Patent US9481685 (2016)


BindingDB Entry DOI: 10.7270/Q25M64NT
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))		BDBM253024
PNG
(US9481685, 2)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccc(OC)cc1n2CCF
Show InChI InChI=1S/C23H25FN2O2S/c1-4-25(5-2)23(27)22-20-16-11-10-15(28-3)14-18(16)26(13-12-24)21(20)17-8-6-7-9-19(17)29-22/h6-11,14,22H,4-5,12-13H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 0.400n/an/an/an/an/an/a7.4n/a



GE Healthcare Limited

US Patent


Assay Description
The compounds were screened for their affinity for PBR using a method adapted from Le Fur et al (Life Sci. 1983; USA 33: 449-57).The compounds to be ...

US Patent US9481685 (2016)


BindingDB Entry DOI: 10.7270/Q25M64NT
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))		BDBM253023
PNG
(US9481685, 6)
Show SMILES CCOc1ccc2n(CCF)c-3c(C(Sc4ccccc-34)C(=O)N(CC)CC)c2c1
Show InChI InChI=1S/C24H27FN2O2S/c1-4-26(5-2)24(28)23-21-18-15-16(29-6-3)11-12-19(18)27(14-13-25)22(21)17-9-7-8-10-20(17)30-23/h7-12,15,23H,4-6,13-14H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 0.520n/an/an/an/an/an/a7.4n/a



GE Healthcare Limited

US Patent


Assay Description
The compounds were screened for their affinity for PBR using a method adapted from Le Fur et al (Life Sci. 1983; USA 33: 449-57).The compounds to be ...

US Patent US9481685 (2016)


BindingDB Entry DOI: 10.7270/Q25M64NT
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))		BDBM50363527
PNG
(CHEMBL1945412 | US9481685, [18F]FE-PBR)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCF
Show InChI InChI=1S/C22H23FN2OS/c1-3-24(4-2)22(26)21-19-15-9-5-7-11-17(15)25(14-13-23)20(19)16-10-6-8-12-18(16)27-21/h5-12,21H,3-4,13-14H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents
US Patent
 0.680n/an/an/an/an/an/a7.4n/a



GE Healthcare Limited

US Patent


Assay Description
The compounds were screened for their affinity for PBR using a method adapted from Le Fur et al (Life Sci. 1983; USA 33: 449-57).The compounds to be ...

US Patent US9481685 (2016)


BindingDB Entry DOI: 10.7270/Q25M64NT
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))		BDBM253020
PNG
(US9481685, 3)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1cccc(OC)c1n2CCF
Show InChI InChI=1S/C23H25FN2O2S/c1-4-25(5-2)23(27)22-19-16-10-8-11-17(28-3)20(16)26(14-13-24)21(19)15-9-6-7-12-18(15)29-22/h6-12,22H,4-5,13-14H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 0.930n/an/an/an/an/an/a7.4n/a



GE Healthcare Limited

US Patent


Assay Description
The compounds were screened for their affinity for PBR using a method adapted from Le Fur et al (Life Sci. 1983; USA 33: 449-57).The compounds to be ...

US Patent US9481685 (2016)


BindingDB Entry DOI: 10.7270/Q25M64NT
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))		BDBM253018
PNG
(US9481685, 7)
Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1c(OC)cccc1n2CCF
Show InChI InChI=1S/C23H25FN2O2S/c1-4-25(5-2)23(27)22-20-19-16(10-8-11-17(19)28-3)26(14-13-24)21(20)15-9-6-7-12-18(15)29-22/h6-12,22H,4-5,13-14H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
 1.09n/an/an/an/an/an/a7.4n/a



GE Healthcare Limited

US Patent


Assay Description
The compounds were screened for their affinity for PBR using a method adapted from Le Fur et al (Life Sci. 1983; USA 33: 449-57).The compounds to be ...

US Patent US9481685 (2016)


BindingDB Entry DOI: 10.7270/Q25M64NT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%