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Patent code US8871790

Compile Data Set for Download or QSAR

Found 475 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
Fatty acid synthase


(Homo sapiens (Human))		BDBM137026
PNG
(US8871790, 92)
Show SMILES CC(C)S(=O)(=O)N1CCc2nc([nH]c2C1)-c1cc(C(=O)N2CCC(CC2)c2ccc(F)cc2)c(C)cc1C
Show InChI InChI=1S/C29H35FN4O3S/c1-18(2)38(36,37)34-14-11-26-27(17-34)32-28(31-26)24-16-25(20(4)15-19(24)3)29(35)33-12-9-22(10-13-33)21-5-7-23(30)8-6-21/h5-8,15-16,18,22H,9-14,17H2,1-4H3,(H,31,32)
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n/an/a 940n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137032
PNG
(US8871790, 98)
Show SMILES Cc1ccc(cc1)C1CCN(CC1)C(=O)c1cc(-c2nc3CCOCc3[nH]2)c(C)cc1C
Show InChI InChI=1S/C27H31N3O2/c1-17-4-6-20(7-5-17)21-8-11-30(12-9-21)27(31)23-15-22(18(2)14-19(23)3)26-28-24-10-13-32-16-25(24)29-26/h4-7,14-15,21H,8-13,16H2,1-3H3,(H,28,29)
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n/an/a 900n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137034
PNG
(US8871790, 100)
Show SMILES Cc1cc(cc(C(=O)N2CCC(CC2)c2ccc(cc2)C#N)c1C)-c1nc2CCOCc2[nH]1
Show InChI InChI=1S/C27H28N4O2/c1-17-13-22(26-29-24-9-12-33-16-25(24)30-26)14-23(18(17)2)27(32)31-10-7-21(8-11-31)20-5-3-19(15-28)4-6-20/h3-6,13-14,21H,7-12,16H2,1-2H3,(H,29,30)
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n/an/a>5.00E+4n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137037
PNG
(US8871790, 103)
Show SMILES COC(=O)N1CCc2nc([nH]c2C1)-c1cc(ccc1C)C(=O)N1CCC(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C28H29N5O3/c1-18-3-6-22(15-23(18)26-30-24-11-14-33(28(35)36-2)17-25(24)31-26)27(34)32-12-9-21(10-13-32)20-7-4-19(16-29)5-8-20/h3-8,15,21H,9-14,17H2,1-2H3,(H,30,31)
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n/an/a 35n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137055
PNG
(US8871790, 123)
Show SMILES O=C(Nc1cc(ccn1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N)c1ccc(nc1)N1CCCC1
Show InChI InChI=1S/C28H28N6O2/c29-18-20-3-5-21(6-4-20)22-10-15-34(16-11-22)28(36)23-9-12-30-25(17-23)32-27(35)24-7-8-26(31-19-24)33-13-1-2-14-33/h3-9,12,17,19,22H,1-2,10-11,13-16H2,(H,30,32,35)
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n/an/a 690n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137064
PNG
(US8871790, 132)
Show SMILES COCc1nnc([nH]1)-c1cc(C(=O)N2CCC(CC2)c2ccc(cc2)C#N)c(C)cc1C
Show InChI InChI=1S/C25H27N5O2/c1-16-12-17(2)22(13-21(16)24-27-23(15-32-3)28-29-24)25(31)30-10-8-20(9-11-30)19-6-4-18(14-26)5-7-19/h4-7,12-13,20H,8-11,15H2,1-3H3,(H,27,28,29)
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n/an/a 450n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137072
PNG
(US8871790, 140)
Show SMILES Cc1cc(C)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nnc(CCC#N)[nH]1
Show InChI InChI=1S/C26H26N6O/c1-17-14-18(2)23(15-22(17)25-29-24(30-31-25)4-3-11-27)26(33)32-12-9-21(10-13-32)20-7-5-19(16-28)6-8-20/h5-8,14-15,21H,3-4,9-10,12-13H2,1-2H3,(H,29,30,31)
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n/an/a 380n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137075
PNG
(US8871790, 143)
Show SMILES COCCc1nnc([nH]1)-c1cc(C(=O)N2CCC(CC2)c2ccc(cc2)C#N)c(C)cc1C1CC1
Show InChI InChI=1S/C28H31N5O2/c1-18-15-24(22-7-8-22)25(27-30-26(31-32-27)11-14-35-2)16-23(18)28(34)33-12-9-21(10-13-33)20-5-3-19(17-29)4-6-20/h3-6,15-16,21-22H,7-14H2,1-2H3,(H,30,31,32)
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n/an/a 140n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137084
PNG
(US8871790, 152 | US8871790, 480)
Show SMILES Cc1nnc([nH]1)-c1cc(C(=O)N2CCC(CC2)c2ccc(cc2)C#N)c(C)cc1C1CCC1
Show InChI InChI=1S/C27H29N5O/c1-17-14-24(22-4-3-5-22)25(26-29-18(2)30-31-26)15-23(17)27(33)32-12-10-21(11-13-32)20-8-6-19(16-28)7-9-20/h6-9,14-15,21-22H,3-5,10-13H2,1-2H3,(H,29,30,31)
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n/an/a 52n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Fatty acid synthase


(Homo sapiens (Human))		BDBM137087
PNG
(US8871790, 155)
Show SMILES Cc1cc(C2CCC2)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nnc(CO)[nH]1
Show InChI InChI=1S/C27H29N5O2/c1-17-13-23(21-3-2-4-21)24(26-29-25(16-33)30-31-26)14-22(17)27(34)32-11-9-20(10-12-32)19-7-5-18(15-28)6-8-19/h5-8,13-14,20-21,33H,2-4,9-12,16H2,1H3,(H,29,30,31)
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n/an/a 20n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137093
PNG
(US8871790, 161)
Show SMILES CCc1nnc([nH]1)-c1cc(C(=O)N2CCC(F)(CC2)c2ccc(cc2)C#N)c(C)cc1C1CCC1
Show InChI InChI=1S/C28H30FN5O/c1-3-25-31-26(33-32-25)24-16-22(18(2)15-23(24)20-5-4-6-20)27(35)34-13-11-28(29,12-14-34)21-9-7-19(17-30)8-10-21/h7-10,15-16,20H,3-6,11-14H2,1-2H3,(H,31,32,33)
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n/an/a 40n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137098
PNG
(US8871790, 166)
Show SMILES Cc1cc(C2CCC2)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nnc([nH]1)C(F)F
Show InChI InChI=1S/C27H27F2N5O/c1-16-13-22(20-3-2-4-20)23(25-31-26(24(28)29)33-32-25)14-21(16)27(35)34-11-9-19(10-12-34)18-7-5-17(15-30)6-8-18/h5-8,13-14,19-20,24H,2-4,9-12H2,1H3,(H,31,32,33)
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n/an/a 160n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137111
PNG
(US8871790, 179)
Show SMILES CCc1cc(Cl)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nnc([nH]1)C1CCOC1
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n/an/a 1.26E+3n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM136953
PNG
(US8871790, 4)
Show SMILES Cc1ccc(cc1-c1nc2CCN(Cc2[nH]1)S(C)(=O)=O)C(=O)N1CCC(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C27H29N5O3S/c1-18-3-6-22(15-23(18)26-29-24-11-14-32(36(2,34)35)17-25(24)30-26)27(33)31-12-9-21(10-13-31)20-7-4-19(16-28)5-8-20/h3-8,15,21H,9-14,17H2,1-2H3,(H,29,30)
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n/an/a 200n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM50426431
PNG
(CHEMBL2322362)
Show SMILES Cc1cc(C)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nc2cc(ncc2[nH]1)S(C)(=O)=O
Show InChI InChI=1S/C28H27N5O3S/c1-17-12-18(2)23(13-22(17)27-31-24-14-26(37(3,35)36)30-16-25(24)32-27)28(34)33-10-8-21(9-11-33)20-6-4-19(15-29)5-7-20/h4-7,12-14,16,21H,8-11H2,1-3H3,(H,31,32)
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n/an/a 85n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM136984
PNG
(US8871790, 49)
Show SMILES CC(C)Nc1ccc(cn1)C(=O)Nc1cc(ccc1C)C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C29H30FN5O2/c1-19(2)33-26-11-8-23(18-32-26)27(36)34-25-16-22(7-4-20(25)3)28(37)35-14-12-29(30,13-15-35)24-9-5-21(17-31)6-10-24/h4-11,16,18-19H,12-15H2,1-3H3,(H,32,33)(H,34,36)
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n/an/a 40n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM136998
PNG
(US8871790, 64)
Show SMILES Cc1cc(C)c(cc1NC(=O)NC[C@H]1CCCO1)C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N |r|
Show InChI InChI=1S/C27H31FN4O3/c1-18-14-19(2)24(31-26(34)30-17-22-4-3-13-35-22)15-23(18)25(33)32-11-9-27(28,10-12-32)21-7-5-20(16-29)6-8-21/h5-8,14-15,22H,3-4,9-13,17H2,1-2H3,(H2,30,31,34)/t22-/m1/s1
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n/an/a 170n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137001
PNG
(US8871790, 67)
Show SMILES CCc1cc(C)c(NC(=O)NC[C@H]2CCCO2)cc1C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N |r|
Show InChI InChI=1S/C28H33FN4O3/c1-3-21-15-19(2)25(32-27(35)31-18-23-5-4-14-36-23)16-24(21)26(34)33-12-10-28(29,11-13-33)22-8-6-20(17-30)7-9-22/h6-9,15-16,23H,3-5,10-14,18H2,1-2H3,(H2,31,32,35)/t23-/m1/s1
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n/an/a 90n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137014
PNG
(US8871790, 80)
Show SMILES Cc1cc(C)c(cc1NC(=O)O[C@@H]1CCOC1)C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N |r|
Show InChI InChI=1S/C26H28FN3O4/c1-17-13-18(2)23(29-25(32)34-21-7-12-33-16-21)14-22(17)24(31)30-10-8-26(27,9-11-30)20-5-3-19(15-28)4-6-20/h3-6,13-14,21H,7-12,16H2,1-2H3,(H,29,32)/t21-/m1/s1
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US Patent
n/an/a 400n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137119
PNG
(US8871790, 187)
Show SMILES CCc1cc(C2CCC2)c(cc1C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N)-c1nnc(CCOC)[nH]1
Show InChI InChI=1S/C30H34FN5O2/c1-3-21-17-24(22-5-4-6-22)26(28-33-27(34-35-28)11-16-38-2)18-25(21)29(37)36-14-12-30(31,13-15-36)23-9-7-20(19-32)8-10-23/h7-10,17-18,22H,3-6,11-16H2,1-2H3,(H,33,34,35)
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n/an/a 65n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137147
PNG
(US8871790, 215)
Show SMILES CCOc1nnc([nH]1)-c1cc(C(=O)N2CCC(CC2)c2ccc(cc2)C#N)c(CC)cc1C1CCC1
Show InChI InChI=1S/C29H33N5O2/c1-3-20-16-24(23-6-5-7-23)26(27-31-29(33-32-27)36-4-2)17-25(20)28(35)34-14-12-22(13-15-34)21-10-8-19(18-30)9-11-21/h8-11,16-17,22-23H,3-7,12-15H2,1-2H3,(H,31,32,33)
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n/an/a 80n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137156
PNG
(US8871790, 224)
Show SMILES COc1nnc([nH]1)-c1cc(C(=O)N2CCC(CC2)c2ccc(cc2)C(F)(F)F)c(C)cc1C1CCC1
Show InChI InChI=1S/C27H29F3N4O2/c1-16-14-22(19-4-3-5-19)23(24-31-26(36-2)33-32-24)15-21(16)25(35)34-12-10-18(11-13-34)17-6-8-20(9-7-17)27(28,29)30/h6-9,14-15,18-19H,3-5,10-13H2,1-2H3,(H,31,32,33)
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n/an/a 160n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137158
PNG
(US8871790, 226)
Show SMILES CCc1cc(C2CC2)c(cc1C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N)-c1nnc(OC)[nH]1
Show InChI InChI=1S/C27H28FN5O2/c1-3-18-14-21(19-6-7-19)23(24-30-26(35-2)32-31-24)15-22(18)25(34)33-12-10-27(28,11-13-33)20-8-4-17(16-29)5-9-20/h4-5,8-9,14-15,19H,3,6-7,10-13H2,1-2H3,(H,30,31,32)
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n/an/a 55n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137173
PNG
(US8871790, 241)
Show SMILES Cc1ncc([nH]1)-c1cc(ccc1C1CCC1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C27H28N4O/c1-18-29-17-26(30-18)25-15-23(9-10-24(25)22-3-2-4-22)27(32)31-13-11-21(12-14-31)20-7-5-19(16-28)6-8-20/h5-10,15,17,21-22H,2-4,11-14H2,1H3,(H,29,30)
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n/an/a 120n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137175
PNG
(US8871790, 243)
Show SMILES COCCc1ncc([nH]1)-c1cc(ccc1C1CCC1)C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C29H31FN4O2/c1-36-16-11-27-32-19-26(33-27)25-17-22(7-10-24(25)21-3-2-4-21)28(35)34-14-12-29(30,13-15-34)23-8-5-20(18-31)6-9-23/h5-10,17,19,21H,2-4,11-16H2,1H3,(H,32,33)
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n/an/a 120n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137176
PNG
(US8871790, 244)
Show SMILES COCCc1ncc([nH]1)-c1cc(ccc1C1CCC1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C29H32N4O2/c1-35-16-13-28-31-19-27(32-28)26-17-24(9-10-25(26)23-3-2-4-23)29(34)33-14-11-22(12-15-33)21-7-5-20(18-30)6-8-21/h5-10,17,19,22-23H,2-4,11-16H2,1H3,(H,31,32)
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n/an/a 220n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137178
PNG
(US8871790, 246)
Show SMILES COCc1cnc([nH]1)-c1cc(C(=O)N2CCC(CC2)c2ccc(cc2)C#N)c(C)cc1C1CCC1
Show InChI InChI=1S/C29H32N4O2/c1-19-14-26(23-4-3-5-23)27(28-31-17-24(32-28)18-35-2)15-25(19)29(34)33-12-10-22(11-13-33)21-8-6-20(16-30)7-9-21/h6-9,14-15,17,22-23H,3-5,10-13,18H2,1-2H3,(H,31,32)
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n/an/a 50n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137092
PNG
(US8871790, 160 | US8871790, 164 | US8871790, 258)
Show SMILES CCc1nnc([nH]1)-c1cc(C(=O)N2CCC(CC2)c2ccc(cc2)C#N)c(C)cc1C1CCC1
Show InChI InChI=1S/C28H31N5O/c1-3-26-30-27(32-31-26)25-16-23(18(2)15-24(25)22-5-4-6-22)28(34)33-13-11-21(12-14-33)20-9-7-19(17-29)8-10-20/h7-10,15-16,21-22H,3-6,11-14H2,1-2H3,(H,30,31,32)
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n/an/a 150n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137193
PNG
(US8871790, 261)
Show SMILES Cc1ccc(cc1C(=O)NCC1CCCO1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C26H29N3O3/c1-18-4-7-22(15-24(18)25(30)28-17-23-3-2-14-32-23)26(31)29-12-10-21(11-13-29)20-8-5-19(16-27)6-9-20/h4-9,15,21,23H,2-3,10-14,17H2,1H3,(H,28,30)
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n/an/a 2.18E+4n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137213
PNG
(US8871790, 283)
Show SMILES Cc1ccc(cc1Nc1nnc(o1)-c1cccnc1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C27H24N6O2/c1-18-4-7-22(15-24(18)30-27-32-31-25(35-27)23-3-2-12-29-17-23)26(34)33-13-10-21(11-14-33)20-8-5-19(16-28)6-9-20/h2-9,12,15,17,21H,10-11,13-14H2,1H3,(H,30,32)
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n/an/a 1.00E+3n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137214
PNG
(US8871790, 284)
Show SMILES CCc1nnc(Nc2cc(ccc2C)C(=O)N2CCC(CC2)c2ccc(cc2)C#N)o1
Show InChI InChI=1S/C24H25N5O2/c1-3-22-27-28-24(31-22)26-21-14-20(7-4-16(21)2)23(30)29-12-10-19(11-13-29)18-8-5-17(15-25)6-9-18/h4-9,14,19H,3,10-13H2,1-2H3,(H,26,28)
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n/an/a 1.01E+3n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137230
PNG
(US8871790, 307)
Show SMILES Cc1ccc(cc1NC(=O)NC1CCC1)C(=O)N1CCC(CC1)c1ccc(cn1)C#N
Show InChI InChI=1S/C24H27N5O2/c1-16-5-7-19(13-22(16)28-24(31)27-20-3-2-4-20)23(30)29-11-9-18(10-12-29)21-8-6-17(14-25)15-26-21/h5-8,13,15,18,20H,2-4,9-12H2,1H3,(H2,27,28,31)
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n/an/a 5.36E+3n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137234
PNG
(US8871790, 313)
Show SMILES Cc1ccc(cc1NC(=O)NC1CCOC1)C(=O)N1CCC(CC1)c1ccc(cn1)C#N
Show InChI InChI=1S/C24H27N5O3/c1-16-2-4-19(12-22(16)28-24(31)27-20-8-11-32-15-20)23(30)29-9-6-18(7-10-29)21-5-3-17(13-25)14-26-21/h2-5,12,14,18,20H,6-11,15H2,1H3,(H2,27,28,31)
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n/an/a 1.63E+3n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137243
PNG
(US8871790, 322)
Show SMILES Cc1ccc(cc1NC(=O)c1ccc(nc1)N1CCC1)C(=O)N1CCC(F)(CC1)c1ccc(cn1)C#N
Show InChI InChI=1S/C28H27FN6O2/c1-19-3-5-21(15-23(19)33-26(36)22-6-8-25(32-18-22)34-11-2-12-34)27(37)35-13-9-28(29,10-14-35)24-7-4-20(16-30)17-31-24/h3-8,15,17-18H,2,9-14H2,1H3,(H,33,36)
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n/an/a 180n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137246
PNG
(US8871790, 325)
Show SMILES CN1CCC(CNC(=O)Nc2cc(ccc2C)C(=O)N2CCC(F)(CC2)c2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C28H34FN5O2/c1-20-3-6-23(17-25(20)32-27(36)31-19-22-9-13-33(2)14-10-22)26(35)34-15-11-28(29,12-16-34)24-7-4-21(18-30)5-8-24/h3-8,17,22H,9-16,19H2,1-2H3,(H2,31,32,36)
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n/an/a 340n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137247
PNG
(US8871790, 326)
Show SMILES Cc1ccc(cc1NC(=O)c1ccc(nc1)N1CCC1)C(=O)N1CCC(CC1)c1ccncc1
Show InChI InChI=1S/C27H29N5O2/c1-19-3-4-22(27(34)32-15-9-21(10-16-32)20-7-11-28-12-8-20)17-24(19)30-26(33)23-5-6-25(29-18-23)31-13-2-14-31/h3-8,11-12,17-18,21H,2,9-10,13-16H2,1H3,(H,30,33)
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n/an/a 2.75E+3n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137253
PNG
(US8871790, 332)
Show SMILES Cc1ccc(cc1NC(=O)NC[C@@H]1CCCO1)C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N |r|
Show InChI InChI=1S/C26H29FN4O3/c1-18-4-7-20(15-23(18)30-25(33)29-17-22-3-2-14-34-22)24(32)31-12-10-26(27,11-13-31)21-8-5-19(16-28)6-9-21/h4-9,15,22H,2-3,10-14,17H2,1H3,(H2,29,30,33)/t22-/m0/s1
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n/an/a 50n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137259
PNG
(US8871790, 339)
Show SMILES Cc1ccc(cc1NC(=O)O[C@H]1CCOC1)C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N |r|
Show InChI InChI=1S/C25H26FN3O4/c1-17-2-5-19(14-22(17)28-24(31)33-21-8-13-32-16-21)23(30)29-11-9-25(26,10-12-29)20-6-3-18(15-27)4-7-20/h2-7,14,21H,8-13,16H2,1H3,(H,28,31)/t21-/m0/s1
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n/an/a 93n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137261
PNG
(US8871790, 341)
Show SMILES CCc1cc(C)c(NC(=O)c2ccc(nc2)N(C)CCOC)cc1C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C32H36FN5O3/c1-5-24-18-22(2)28(36-30(39)25-8-11-29(35-21-25)37(3)16-17-41-4)19-27(24)31(40)38-14-12-32(33,13-15-38)26-9-6-23(20-34)7-10-26/h6-11,18-19,21H,5,12-17H2,1-4H3,(H,36,39)
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US Patent
n/an/a 85n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137263
PNG
(US8871790, 343)
Show SMILES Cc1cc(C)c(cc1NC(=O)c1ccc(nc1)N1CCOCC1)C(=O)N1CCC(F)(CC1)c1ccc(cn1)C#N
Show InChI InChI=1S/C30H31FN6O3/c1-20-15-21(2)25(35-28(38)23-4-6-27(34-19-23)36-11-13-40-14-12-36)16-24(20)29(39)37-9-7-30(31,8-10-37)26-5-3-22(17-32)18-33-26/h3-6,15-16,18-19H,7-14H2,1-2H3,(H,35,38)
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n/an/a 600n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137269
PNG
(US8871790, 349)
Show SMILES CC(C)Nc1ccc(cn1)C(=O)Nc1cc(ncc1C)C(=O)N1CCC(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C28H30N6O2/c1-18(2)32-26-9-8-23(17-31-26)27(35)33-24-14-25(30-16-19(24)3)28(36)34-12-10-22(11-13-34)21-6-4-20(15-29)5-7-21/h4-9,14,16-18,22H,10-13H2,1-3H3,(H,31,32)(H,30,33,35)
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n/an/a>5.00E+4n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137285
PNG
(US8871790, 365)
Show SMILES CN1CCC(CC1)NC(=O)Nc1cc(ccc1C)C(=O)N1CCC2(CC1)OCc1cc(ccc21)C#N
Show InChI InChI=1S/C28H33N5O3/c1-19-3-5-21(16-25(19)31-27(35)30-23-7-11-32(2)12-8-23)26(34)33-13-9-28(10-14-33)24-6-4-20(17-29)15-22(24)18-36-28/h3-6,15-16,23H,7-14,18H2,1-2H3,(H2,30,31,35)
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n/an/a 310n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137292
PNG
(US8871790, 376)
Show SMILES CC(C)CNC(=O)Nc1cc(cnc1C)C(=O)N1CCC(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C24H29N5O2/c1-16(2)14-27-24(31)28-22-12-21(15-26-17(22)3)23(30)29-10-8-20(9-11-29)19-6-4-18(13-25)5-7-19/h4-7,12,15-16,20H,8-11,14H2,1-3H3,(H2,27,28,31)
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n/an/a 6.07E+3n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137298
PNG
(US8871790, 383)
Show SMILES Cc1ccc(nc1NC(=O)NC1CCOC1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C24H27N5O3/c1-16-2-7-21(27-22(16)28-24(31)26-20-10-13-32-15-20)23(30)29-11-8-19(9-12-29)18-5-3-17(14-25)4-6-18/h2-7,19-20H,8-13,15H2,1H3,(H2,26,27,28,31)
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n/an/a>5.00E+4n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137303
PNG
(US8871790, 389)
Show SMILES CC(C)NC(=O)Nc1cc(C(=O)N2CCC(CC2)c2ccc(cc2)C#N)n(C)n1
Show InChI InChI=1S/C21H26N6O2/c1-14(2)23-21(29)24-19-12-18(26(3)25-19)20(28)27-10-8-17(9-11-27)16-6-4-15(13-22)5-7-16/h4-7,12,14,17H,8-11H2,1-3H3,(H2,23,24,25,29)
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n/an/a 1.66E+4n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137326
PNG
(US8871790, 412)
Show SMILES CCc1cc(C2CC2)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1nc2CCN(C)Cc2[nH]1
Show InChI InChI=1S/C31H35N5O/c1-3-21-16-25(24-8-9-24)27(30-33-28-12-13-35(2)19-29(28)34-30)17-26(21)31(37)36-14-10-23(11-15-36)22-6-4-20(18-32)5-7-22/h4-7,16-17,23-24H,3,8-15,19H2,1-2H3,(H,33,34)
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n/an/a 35n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137329
PNG
(US8871790, 415)
Show SMILES CC1COCc2[nH]c(nc12)-c1cc(ccc1C1CCC1)C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N
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n/an/a 40n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137331
PNG
(US8871790, 417)
Show SMILES CN1CCc2nc([nH]c2C1)-c1cc(ccc1C1CCC1)C(=O)N1CCC(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C30H33N5O/c1-34-14-13-27-28(19-34)33-29(32-27)26-17-24(9-10-25(26)23-3-2-4-23)30(36)35-15-11-22(12-16-35)21-7-5-20(18-31)6-8-21/h5-10,17,22-23H,2-4,11-16,19H2,1H3,(H,32,33)
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n/an/a 20n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137332
PNG
(US8871790, 418)
Show SMILES CN1CCc2nc([nH]c2C1)-c1cc(ccc1C1CCC1)C(=O)N1CCC(F)(CC1)c1ccc(cc1)C#N
Show InChI InChI=1S/C30H32FN5O/c1-35-14-11-26-27(19-35)34-28(33-26)25-17-22(7-10-24(25)21-3-2-4-21)29(37)36-15-12-30(31,13-16-36)23-8-5-20(18-32)6-9-23/h5-10,17,21H,2-4,11-16,19H2,1H3,(H,33,34)
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n/an/a 50n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
Fatty acid synthase


(Homo sapiens (Human))		BDBM137339
PNG
(US8871790, 425)
Show SMILES CN1CCc2[nH]c(nc2C1)-c1cc(C(=O)N2CCC(CC2)c2ccc(cc2)C#N)c(C)cc1C
Show InChI InChI=1S/C28H31N5O/c1-18-14-19(2)24(15-23(18)27-30-25-10-11-32(3)17-26(25)31-27)28(34)33-12-8-22(9-13-33)21-6-4-20(16-29)5-7-21/h4-7,14-15,22H,8-13,17H2,1-3H3,(H,30,31)
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n/an/a 75n/an/an/an/an/an/a



3-V Biosciences, Inc.

US Patent


Assay Description
The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...

US Patent US8871790 (2014)


BindingDB Entry DOI: 10.7270/Q2PG1QD3
More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%