BindingDB logo
myBDB logout

Patent code US10647665

Compile Data Set for Download or QSAR
Found 39 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 (RORC)


(Homo sapiens (Human))
BDBM441818
PNG
(US10647665, Example 1-7)
Show SMILES CC(=O)NS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H18Cl2F3N3O5S/c1-13(32)31-37(34,35)16-8-6-14(7-9-16)12-29-22(33)30-15-10-18(24)21(19(25)11-15)17-4-2-3-5-20(17)36-23(26,27)28/h2-11H,12H2,1H3,(H,31,32)(H2,29,30,33)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441846
PNG
(US10647665, Example 1-32 | US10647665, Example 1-3...)
Show SMILES CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H19Cl2F3N2O4S/c1-2-35(32,33)16-9-7-14(8-10-16)13-29-22(31)30-15-11-18(24)21(19(25)12-15)17-5-3-4-6-20(17)34-23(26,27)28/h3-12H,2,13H2,1H3,(H2,29,30,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441830
PNG
(US10647665, Example 1-17)
Show SMILES Cc1cc(NC(=O)NCc2ccc(CC(O)=O)cc2)cc(Cl)c1-c1ccccc1OC(F)(F)F
Show InChI InChI=1S/C24H20ClF3N2O4/c1-14-10-17(30-23(33)29-13-16-8-6-15(7-9-16)11-21(31)32)12-19(25)22(14)18-4-2-3-5-20(18)34-24(26,27)28/h2-10,12H,11,13H2,1H3,(H,31,32)(H2,29,30,33)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441828
PNG
(US10647665, Example 1-15)
Show SMILES OC(=O)Cc1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H17Cl2F3N2O4/c24-17-10-15(30-22(33)29-12-14-7-5-13(6-8-14)9-20(31)32)11-18(25)21(17)16-3-1-2-4-19(16)34-23(26,27)28/h1-8,10-11H,9,12H2,(H,31,32)(H2,29,30,33)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441825
PNG
(US10647665, Example 1-13)
Show SMILES CNS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)nc1
Show InChI InChI=1S/C21H17Cl2F3N4O4S/c1-27-35(32,33)14-7-6-12(28-11-14)10-29-20(31)30-13-8-16(22)19(17(23)9-13)15-4-2-3-5-18(15)34-21(24,25)26/h2-9,11,27H,10H2,1H3,(H2,29,30,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441815
PNG
(US10647665, Example 1-4)
Show SMILES CS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C22H17Cl2F3N2O4S/c1-34(31,32)15-8-6-13(7-9-15)12-28-21(30)29-14-10-17(23)20(18(24)11-14)16-4-2-3-5-19(16)33-22(25,26)27/h2-11H,12H2,1H3,(H2,28,29,30)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441812
PNG
(US10647665, Example I-1)
Show SMILES CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H19Cl2F3N2O4S/c1-2-35(32,33)16-9-7-14(8-10-16)13-29-22(31)30-15-11-18(24)21(19(25)12-15)17-5-3-4-6-20(17)34-23(26,27)28/h3-12H,2,13H2,1H3,(H2,29,30,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441833
PNG
(US10647665, Example 1-20)
Show SMILES OC(=O)Cc1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)F)cc1
Show InChI InChI=1S/C23H18Cl2F2N2O4/c24-17-10-15(11-18(25)21(17)16-3-1-2-4-19(16)33-22(26)27)29-23(32)28-12-14-7-5-13(6-8-14)9-20(30)31/h1-8,10-11,22H,9,12H2,(H,30,31)(H2,28,29,32)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441817
PNG
(US10647665, Example 1-6)
Show SMILES NS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C21H16Cl2F3N3O4S/c22-16-9-13(29-20(30)28-11-12-5-7-14(8-6-12)34(27,31)32)10-17(23)19(16)15-3-1-2-4-18(15)33-21(24,25)26/h1-10H,11H2,(H2,27,31,32)(H2,28,29,30)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441823
PNG
(US10647665, Example 1-12)
Show SMILES CS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)nc1
Show InChI InChI=1S/C21H16Cl2F3N3O4S/c1-34(31,32)14-7-6-12(27-11-14)10-28-20(30)29-13-8-16(22)19(17(23)9-13)15-4-2-3-5-18(15)33-21(24,25)26/h2-9,11H,10H2,1H3,(H2,28,29,30)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441822
PNG
(US10647665, Example 1-11)
Show SMILES CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)nc1
Show InChI InChI=1S/C22H18Cl2F3N3O4S/c1-2-35(32,33)15-8-7-13(28-12-15)11-29-21(31)30-14-9-17(23)20(18(24)10-14)16-5-3-4-6-19(16)34-22(25,26)27/h3-10,12H,2,11H2,1H3,(H2,29,30,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441820
PNG
(US10647665, Example 1-9)
Show SMILES CCS(=N)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H20Cl2F3N3O3S/c1-2-35(29,33)16-9-7-14(8-10-16)13-30-22(32)31-15-11-18(24)21(19(25)12-15)17-5-3-4-6-20(17)34-23(26,27)28/h3-12,29H,2,13H2,1H3,(H2,30,31,32)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441846
PNG
(US10647665, Example 1-32 | US10647665, Example 1-3...)
Show SMILES CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H19Cl2F3N2O4S/c1-2-35(32,33)16-9-7-14(8-10-16)13-29-22(31)30-15-11-18(24)21(19(25)12-15)17-5-3-4-6-20(17)34-23(26,27)28/h3-12H,2,13H2,1H3,(H2,29,30,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441846
PNG
(US10647665, Example 1-32 | US10647665, Example 1-3...)
Show SMILES CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H19Cl2F3N2O4S/c1-2-35(32,33)16-9-7-14(8-10-16)13-29-22(31)30-15-11-18(24)21(19(25)12-15)17-5-3-4-6-20(17)34-23(26,27)28/h3-12H,2,13H2,1H3,(H2,29,30,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441846
PNG
(US10647665, Example 1-32 | US10647665, Example 1-3...)
Show SMILES CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H19Cl2F3N2O4S/c1-2-35(32,33)16-9-7-14(8-10-16)13-29-22(31)30-15-11-18(24)21(19(25)12-15)17-5-3-4-6-20(17)34-23(26,27)28/h3-12H,2,13H2,1H3,(H2,29,30,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441846
PNG
(US10647665, Example 1-32 | US10647665, Example 1-3...)
Show SMILES CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H19Cl2F3N2O4S/c1-2-35(32,33)16-9-7-14(8-10-16)13-29-22(31)30-15-11-18(24)21(19(25)12-15)17-5-3-4-6-20(17)34-23(26,27)28/h3-12H,2,13H2,1H3,(H2,29,30,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441834
PNG
(US10647665, Example 1-21)
Show SMILES Cc1cc(NC(=O)NCc2ccc(CC(O)=O)cc2)cc(C)c1-c1ccccc1OC(F)F
Show InChI InChI=1S/C25H24F2N2O4/c1-15-11-19(12-16(2)23(15)20-5-3-4-6-21(20)33-24(26)27)29-25(32)28-14-18-9-7-17(8-10-18)13-22(30)31/h3-12,24H,13-14H2,1-2H3,(H,30,31)(H2,28,29,32)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441839
PNG
(US10647665, Example 1-25)
Show SMILES OC(=O)C(F)(F)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H15Cl2F5N2O4/c24-16-9-14(10-17(25)19(16)15-3-1-2-4-18(15)36-23(28,29)30)32-21(35)31-11-12-5-7-13(8-6-12)22(26,27)20(33)34/h1-10H,11H2,(H,33,34)(H2,31,32,35)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441846
PNG
(US10647665, Example 1-32 | US10647665, Example 1-3...)
Show SMILES CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H19Cl2F3N2O4S/c1-2-35(32,33)16-9-7-14(8-10-16)13-29-22(31)30-15-11-18(24)21(19(25)12-15)17-5-3-4-6-20(17)34-23(26,27)28/h3-12H,2,13H2,1H3,(H2,29,30,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441816
PNG
(US10647665, Example 1-5)
Show SMILES CNS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C22H18Cl2F3N3O4S/c1-28-35(32,33)15-8-6-13(7-9-15)12-29-21(31)30-14-10-17(23)20(18(24)11-14)16-4-2-3-5-19(16)34-22(25,26)27/h2-11,28H,12H2,1H3,(H2,29,30,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441829
PNG
(US10647665, Example 1-16)
Show SMILES OC(=O)Cc1ccc(CNC(=O)Nc2cc(Cl)c(c(c2)C#N)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C24H17ClF3N3O4/c25-19-11-17(31-23(34)30-13-15-7-5-14(6-8-15)9-21(32)33)10-16(12-29)22(19)18-3-1-2-4-20(18)35-24(26,27)28/h1-8,10-11H,9,13H2,(H,32,33)(H2,30,31,34)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441843
PNG
(US10647665, Example 1-29)
Show SMILES OC(=O)Cc1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)nc1
Show InChI InChI=1S/C22H16Cl2F3N3O4/c23-16-8-14(30-21(33)29-11-13-6-5-12(10-28-13)7-19(31)32)9-17(24)20(16)15-3-1-2-4-18(15)34-22(25,26)27/h1-6,8-10H,7,11H2,(H,31,32)(H2,29,30,33)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a<500n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441846
PNG
(US10647665, Example 1-32 | US10647665, Example 1-3...)
Show SMILES CCS(=O)(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H19Cl2F3N2O4S/c1-2-35(32,33)16-9-7-14(8-10-16)13-29-22(31)30-15-11-18(24)21(19(25)12-15)17-5-3-4-6-20(17)34-23(26,27)28/h3-12H,2,13H2,1H3,(H2,29,30,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441844
PNG
(US10647665, Example 1-30)
Show SMILES CC(C(O)=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)nc1
Show InChI InChI=1S/C23H18Cl2F3N3O4/c1-12(21(32)33)13-6-7-14(29-10-13)11-30-22(34)31-15-8-17(24)20(18(25)9-15)16-4-2-3-5-19(16)35-23(26,27)28/h2-10,12H,11H2,1H3,(H,32,33)(H2,30,31,34)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441827
PNG
(US10647665, Example 1-14)
Show SMILES OC(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C22H15Cl2F3N2O4/c23-16-9-14(29-21(32)28-11-12-5-7-13(8-6-12)20(30)31)10-17(24)19(16)15-3-1-2-4-18(15)33-22(25,26)27/h1-10H,11H2,(H,30,31)(H2,28,29,32)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441838
PNG
(US10647665, Example 1-24)
Show SMILES CC(C(O)=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C24H19Cl2F3N2O4/c1-13(22(32)33)15-8-6-14(7-9-15)12-30-23(34)31-16-10-18(25)21(19(26)11-16)17-4-2-3-5-20(17)35-24(27,28)29/h2-11,13H,12H2,1H3,(H,32,33)(H2,30,31,34)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441841
PNG
(US10647665, Example 1-27)
Show SMILES CN(C(=O)NCc1ccc(CC(O)=O)cc1)c1cc(Cl)c(c(Cl)c1)-c1ccccc1OC(F)(F)F
Show InChI InChI=1S/C24H19Cl2F3N2O4/c1-31(23(34)30-13-15-8-6-14(7-9-15)10-21(32)33)16-11-18(25)22(19(26)12-16)17-4-2-3-5-20(17)35-24(27,28)29/h2-9,11-12H,10,13H2,1H3,(H,30,34)(H,32,33)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441832
PNG
(US10647665, Example 1-19)
Show SMILES OC(=O)Cc1ccc(CNC(=O)Nc2cc(F)c(c(F)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H17F5N2O4/c24-17-10-15(30-22(33)29-12-14-7-5-13(6-8-14)9-20(31)32)11-18(25)21(17)16-3-1-2-4-19(16)34-23(26,27)28/h1-8,10-11H,9,12H2,(H,31,32)(H2,29,30,33)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441819
PNG
(US10647665, Example 1-8)
Show SMILES CS(=O)(=O)Nc1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C22H18Cl2F3N3O4S/c1-35(32,33)30-14-8-6-13(7-9-14)12-28-21(31)29-15-10-17(23)20(18(24)11-15)16-4-2-3-5-19(16)34-22(25,26)27/h2-11,30H,12H2,1H3,(H2,28,29,31)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441814
PNG
(US10647665, Example 1-3)
Show SMILES CCS(=O)(=O)c1ccc(CNC(=O)Nc2ccc(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H20ClF3N2O4S/c1-2-34(31,32)17-10-7-15(8-11-17)14-28-22(30)29-16-9-12-18(20(24)13-16)19-5-3-4-6-21(19)33-23(25,26)27/h3-13H,2,14H2,1H3,(H2,28,29,30)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441840
PNG
(US10647665, Example 1-26)
Show SMILES OC(=O)COc1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H17Cl2F3N2O5/c24-17-9-14(10-18(25)21(17)16-3-1-2-4-19(16)35-23(26,27)28)30-22(33)29-11-13-5-7-15(8-6-13)34-12-20(31)32/h1-10H,11-12H2,(H,31,32)(H2,29,30,33)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441842
PNG
(US10647665, Example 1-28)
Show SMILES CN(Cc1ccc(CC(O)=O)cc1)C(=O)Nc1cc(Cl)c(c(Cl)c1)-c1ccccc1OC(F)(F)F
Show InChI InChI=1S/C24H19Cl2F3N2O4/c1-31(13-15-8-6-14(7-9-15)10-21(32)33)23(34)30-16-11-18(25)22(19(26)12-16)17-4-2-3-5-20(17)35-24(27,28)29/h2-9,11-12H,10,13H2,1H3,(H,30,34)(H,32,33)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441836
PNG
(US10647665, Example 1-22b)
Show SMILES Cn1cc(cn1)-c1cccc(OC(F)(F)F)c1-c1ccc(NC(=O)NCc2ccc(CC(O)=O)cc2)cc1
Show InChI InChI=1S/C27H23F3N4O4/c1-34-16-20(15-32-34)22-3-2-4-23(38-27(28,29)30)25(22)19-9-11-21(12-10-19)33-26(37)31-14-18-7-5-17(6-8-18)13-24(35)36/h2-12,15-16H,13-14H2,1H3,(H,35,36)(H2,31,33,37)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441821
PNG
(US10647665, Example 1-10)
Show SMILES CS(=O)(=O)NC(=O)c1ccc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H18Cl2F3N3O5S/c1-37(34,35)31-21(32)14-8-6-13(7-9-14)12-29-22(33)30-15-10-17(24)20(18(25)11-15)16-4-2-3-5-19(16)36-23(26,27)28/h2-11H,12H2,1H3,(H,31,32)(H2,29,30,33)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441845
PNG
(US10647665, Example 1-31)
Show SMILES Cc1cc(CNC(=O)Nc2cc(Cl)c(c(Cl)c2)-c2ccccc2OC(F)(F)F)ccc1CC(O)=O
Show InChI InChI=1S/C24H19Cl2F3N2O4/c1-13-8-14(6-7-15(13)9-21(32)33)12-30-23(34)31-16-10-18(25)22(19(26)11-16)17-4-2-3-5-20(17)35-24(27,28)29/h2-8,10-11H,9,12H2,1H3,(H,32,33)(H2,30,31,34)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441835
PNG
(US10647665, Example 1-22a)
Show SMILES Cn1cc(cn1)-c1cc(NC(=O)NCc2ccc(CC(O)=O)cc2)ccc1-c1ccccc1OC(F)(F)F
Show InChI InChI=1S/C27H23F3N4O4/c1-34-16-19(15-32-34)23-13-20(10-11-21(23)22-4-2-3-5-24(22)38-27(28,29)30)33-26(37)31-14-18-8-6-17(7-9-18)12-25(35)36/h2-11,13,15-16H,12,14H2,1H3,(H,35,36)(H2,31,33,37)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441831
PNG
(US10647665, Example 1-18)
Show SMILES OC(=O)Cc1ccc(CNC(=O)Nc2ccc(c(Cl)c2)-c2ccccc2OC(F)(F)F)cc1
Show InChI InChI=1S/C23H18ClF3N2O4/c24-19-12-16(9-10-17(19)18-3-1-2-4-20(18)33-23(25,26)27)29-22(32)28-13-15-7-5-14(6-8-15)11-21(30)31/h1-10,12H,11,13H2,(H,30,31)(H2,28,29,32)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a 2.75E+3n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441837
PNG
(US10647665, Example 1-23)
Show SMILES OC(=O)Cc1ccc(CNC(=O)Nc2ccc(cc2)-c2ccccc2)cc1
Show InChI InChI=1S/C22H20N2O3/c25-21(26)14-16-6-8-17(9-7-16)15-23-22(27)24-20-12-10-19(11-13-20)18-4-2-1-3-5-18/h1-13H,14-15H2,(H,25,26)(H2,23,24,27)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
KEGG
UniChem
US Patent
n/an/a 2.75E+5n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
Nuclear receptor ROR-gamma (RORC)


(Homo sapiens (Human))
BDBM441813
PNG
(US10647665, Example 1-2)
Show SMILES CCS(=O)(=O)c1ccc(CNC(=O)Nc2ccc(cc2)-c2ccccc2)cc1
Show InChI InChI=1S/C22H22N2O3S/c1-2-28(26,27)21-14-8-17(9-15-21)16-23-22(25)24-20-12-10-19(11-13-20)18-6-4-3-5-7-18/h3-15H,2,16H2,1H3,(H2,23,24,25)
PDB

Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
UniChem
US Patent
n/an/a 2.75E+5n/an/an/an/an/an/a



Fudan University

US Patent


Assay Description
1. Preparation of RORgamma Buffer Solution10 mL of DTT and 100 mL buffer solution were gently mixed together and ready to use.2. Preparation of Compo...


US Patent US10647665 (2020)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%