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Patent code US9321750

Compile Data Set for Download or QSAR
Found 5 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
Nuclear receptor ROR-gamma


(Homo sapiens (Human))		BDBM223574
PNG
(US9321750, 6)
Show SMILES CS(=O)(=O)Nc1ccc2N(Cc3ccc(cc3)C(O)(C(F)(F)F)C(F)(F)F)C(=O)CCc2c1
Show InChI InChI=1S/C20H18F6N2O4S/c1-33(31,32)27-15-7-8-16-13(10-15)4-9-17(29)28(16)11-12-2-5-14(6-3-12)18(30,19(21,22)23)20(24,25)26/h2-3,5-8,10,27,30H,4,9,11H2,1H3
PDB

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US Patent
n/an/a<1.00E+4n/an/an/an/an/an/a



INNOV17 LLC

US Patent


Assay Description
Compound binding to the human RORγ LBD was assessed using the Human RORγ Assay System (INDIGO Biosciences Inc.) as per manufacturer's i...

US Patent US9321750 (2016)


BindingDB Entry DOI: 10.7270/Q2Z0371S
More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma


(Homo sapiens (Human))		BDBM223572
PNG
(US9321750, 4)
Show SMILES CC(=O)Nc1ccc2N(Cc3ccc(cc3)C(O)(C(F)(F)F)C(F)(F)F)CCc2c1
Show InChI InChI=1S/C20H18F6N2O2/c1-12(29)27-16-6-7-17-14(10-16)8-9-28(17)11-13-2-4-15(5-3-13)18(30,19(21,22)23)20(24,25)26/h2-7,10,30H,8-9,11H2,1H3,(H,27,29)
PDB

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antibodypedia
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US Patent
n/an/a<1.00E+4n/an/an/an/an/an/a



INNOV17 LLC

US Patent


Assay Description
Compound binding to the human RORγ LBD was assessed using the Human RORγ Assay System (INDIGO Biosciences Inc.) as per manufacturer's i...

US Patent US9321750 (2016)


BindingDB Entry DOI: 10.7270/Q2Z0371S
More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma


(Homo sapiens (Human))		BDBM223573
PNG
(US9321750, 5)
Show SMILES CS(=O)(=O)Nc1ccc2N(Cc3ccc(cc3)C(O)(C(F)(F)F)C(F)(F)F)CCCc2c1
Show InChI InChI=1S/C20H20F6N2O3S/c1-32(30,31)27-16-8-9-17-14(11-16)3-2-10-28(17)12-13-4-6-15(7-5-13)18(29,19(21,22)23)20(24,25)26/h4-9,11,27,29H,2-3,10,12H2,1H3
PDB

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US Patent
n/an/a<1.00E+4n/an/an/an/an/an/a



INNOV17 LLC

US Patent


Assay Description
Compound binding to the human RORγ LBD was assessed using the Human RORγ Assay System (INDIGO Biosciences Inc.) as per manufacturer's i...

US Patent US9321750 (2016)


BindingDB Entry DOI: 10.7270/Q2Z0371S
More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma


(Homo sapiens (Human))		BDBM50044251
PNG
(CHEMBL3314037 | US9321750, 2)
Show SMILES CC(=O)Nc1ccc2N(Cc3ccc(cc3)C(O)(C(F)(F)F)C(F)(F)F)CCCc2c1
Show InChI InChI=1S/C21H20F6N2O2/c1-13(30)28-17-8-9-18-15(11-17)3-2-10-29(18)12-14-4-6-16(7-5-14)19(31,20(22,23)24)21(25,26)27/h4-9,11,31H,2-3,10,12H2,1H3,(H,28,30)
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US Patent
n/an/a<1.00E+4n/an/an/an/an/an/a



INNOV17 LLC

US Patent


Assay Description
Compound binding to the human RORγ LBD was assessed using the Human RORγ Assay System (INDIGO Biosciences Inc.) as per manufacturer's i...

US Patent US9321750 (2016)


BindingDB Entry DOI: 10.7270/Q2Z0371S
More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma


(Homo sapiens (Human))		BDBM223571
PNG
(US9321750, 3)
Show SMILES CC(=O)Nc1ccc2N(Cc3ccc(cc3)C(O)(C(F)(F)F)C(F)(F)F)C(=O)CCc2c1
Show InChI InChI=1S/C21H18F6N2O3/c1-12(30)28-16-7-8-17-14(10-16)4-9-18(31)29(17)11-13-2-5-15(6-3-13)19(32,20(22,23)24)21(25,26)27/h2-3,5-8,10,32H,4,9,11H2,1H3,(H,28,30)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



INNOV17 LLC

US Patent


Assay Description
Compound binding to the human RORγ LBD was assessed using the Human RORγ Assay System (INDIGO Biosciences Inc.) as per manufacturer's i...

US Patent US9321750 (2016)


BindingDB Entry DOI: 10.7270/Q2Z0371S
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%