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PubMed code 8568811

Compile data set for download or QSAR
Found 22 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
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048961
PNG
(4'-((R)-2-Amino-3-mercapto-propylamino)-2'-methoxy...)
Show SMILES COc1cc(NC[C@@H](N)CS)ccc1-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C17H20N2O3S/c1-22-16-8-14(19-9-13(18)10-23)5-6-15(16)11-3-2-4-12(7-11)17(20)21/h2-8,13,19,23H,9-10,18H2,1H3,(H,20,21)/t13-/m1/s1
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n/an/a 40n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048953
PNG
(4'-((R)-2-Amino-3-mercapto-propylamino)-biphenyl-3...)
Show SMILES N[C@@H](CS)CNc1ccc(cc1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C16H18N2O2S/c17-14(10-21)9-18-15-6-4-11(5-7-15)12-2-1-3-13(8-12)16(19)20/h1-8,14,18,21H,9-10,17H2,(H,19,20)/t14-/m1/s1
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n/an/a 114n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048955
PNG
((S)-2-[4-((R)-2-Amino-3-mercapto-propionylamino)-b...)
Show SMILES CSCC[C@H](NC(=O)c1ccc(NC(=O)[C@@H](N)CS)cc1)C(O)=O
Show InChI InChI=1S/C15H21N3O4S2/c1-24-7-6-12(15(21)22)18-13(19)9-2-4-10(5-3-9)17-14(20)11(16)8-23/h2-5,11-12,23H,6-8,16H2,1H3,(H,17,20)(H,18,19)(H,21,22)/t11-,12-/m0/s1
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n/an/a 150n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50108076
PNG
((S)-2-{(S)-2-[(S)-2-((R)-2-Amino-3-mercapto-propio...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CS)C(C)C)C(=O)N[C@@H](CCSC)C(O)=O
Show InChI InChI=1S/C19H36N4O5S2/c1-6-11(4)15(18(26)21-13(19(27)28)7-8-30-5)23-17(25)14(10(2)3)22-16(24)12(20)9-29/h10-15,29H,6-9,20H2,1-5H3,(H,21,26)(H,22,24)(H,23,25)(H,27,28)/t11-,12-,13-,14-,15-/m0/s1
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n/an/a 200n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048952
PNG
(4'-((R)-2-Amino-3-mercapto-propylamino)-biphenyl-2...)
Show SMILES N[C@@H](CS)CNc1ccc(cc1)-c1ccccc1C(O)=O
Show InChI InChI=1S/C16H18N2O2S/c17-12(10-21)9-18-13-7-5-11(6-8-13)14-3-1-2-4-15(14)16(19)20/h1-8,12,18,21H,9-10,17H2,(H,19,20)/t12-/m1/s1
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n/an/a 543n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
Inhibition of pig brain farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048956
PNG
((R)-2-Amino-3-(3'-methyl-biphenyl-4-ylamino)-propa...)
Show SMILES Cc1cccc(c1)-c1ccc(NC[C@@H](N)CS)cc1
Show InChI InChI=1S/C16H20N2S/c1-12-3-2-4-14(9-12)13-5-7-16(8-6-13)18-10-15(17)11-19/h2-9,15,18-19H,10-11,17H2,1H3/t15-/m1/s1
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n/an/a 710n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048960
PNG
(4'-((R)-2-Amino-3-mercapto-propylamino)-biphenyl-3...)
Show SMILES COC(=O)c1cccc(c1)-c1ccc(NC[C@@H](N)CS)cc1
Show InChI InChI=1S/C17H20N2O2S/c1-21-17(20)14-4-2-3-13(9-14)12-5-7-16(8-6-12)19-10-15(18)11-22/h2-9,15,19,22H,10-11,18H2,1H3/t15-/m1/s1
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n/an/a 917n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048954
PNG
((R)-2-Amino-3-(biphenyl-4-ylamino)-propane-1-thiol...)
Show SMILES N[C@@H](CS)CNc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C15H18N2S/c16-14(11-18)10-17-15-8-6-13(7-9-15)12-4-2-1-3-5-12/h1-9,14,17-18H,10-11,16H2/t14-/m1/s1
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n/an/a 1.07E+3n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048959
PNG
(4'-((R)-2-Amino-3-mercapto-propylamino)-biphenyl-4...)
Show SMILES N[C@@H](CS)CNc1ccc(cc1)-c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C16H18N2O2S/c17-14(10-21)9-18-15-7-5-12(6-8-15)11-1-3-13(4-2-11)16(19)20/h1-8,14,18,21H,9-10,17H2,(H,19,20)/t14-/m1/s1
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n/an/a 4.58E+3n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048958
PNG
(3'-[((R)-2-Amino-3-mercapto-propylamino)-methyl]-b...)
Show SMILES N[C@@H](CS)CNCc1cccc(c1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C17H20N2O2S/c18-16(11-22)10-19-9-12-3-1-4-13(7-12)14-5-2-6-15(8-14)17(20)21/h1-8,16,19,22H,9-11,18H2,(H,20,21)/t16-/m1/s1
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n/an/a 1.10E+4n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048957
PNG
(4'-((R)-2-Amino-3-mercapto-propionylamino)-bipheny...)
Show SMILES N[C@@H](CS)C(=O)Nc1ccc(cc1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C16H16N2O3S/c17-14(9-22)15(19)18-13-6-4-10(5-7-13)11-2-1-3-12(8-11)16(20)21/h1-8,14,22H,9,17H2,(H,18,19)(H,20,21)/t14-/m0/s1
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n/an/a 1.35E+4n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048958
PNG
(3'-[((R)-2-Amino-3-mercapto-propylamino)-methyl]-b...)
Show SMILES N[C@@H](CS)CNCc1cccc(c1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C17H20N2O2S/c18-16(11-22)10-19-9-12-3-1-4-13(7-12)14-5-2-6-15(8-14)17(20)21/h1-8,16,19,22H,9-11,18H2,(H,20,21)/t16-/m1/s1
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n/an/a 3.50E+4n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Geranylgeranyl transferase type I


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048961
PNG
(4'-((R)-2-Amino-3-mercapto-propylamino)-2'-methoxy...)
Show SMILES COc1cc(NC[C@@H](N)CS)ccc1-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C17H20N2O3S/c1-22-16-8-14(19-9-13(18)10-23)5-6-15(16)11-3-2-4-12(7-11)17(20)21/h2-8,13,19,23H,9-10,18H2,1H3,(H,20,21)/t13-/m1/s1
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n/an/a 4.36E+4n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Geranylgeranyl transferase type I


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048954
PNG
((R)-2-Amino-3-(biphenyl-4-ylamino)-propane-1-thiol...)
Show SMILES N[C@@H](CS)CNc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C15H18N2S/c16-14(11-18)10-17-15-8-6-13(7-9-15)12-4-2-1-3-5-12/h1-9,14,17-18H,10-11,16H2/t14-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Geranylgeranyl transferase type I


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048960
PNG
(4'-((R)-2-Amino-3-mercapto-propylamino)-biphenyl-3...)
Show SMILES COC(=O)c1cccc(c1)-c1ccc(NC[C@@H](N)CS)cc1
Show InChI InChI=1S/C17H20N2O2S/c1-21-17(20)14-4-2-3-13(9-14)12-5-7-16(8-6-12)19-10-15(18)11-22/h2-9,15,19,22H,10-11,18H2,1H3/t15-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Geranylgeranyl transferase type I


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048956
PNG
((R)-2-Amino-3-(3'-methyl-biphenyl-4-ylamino)-propa...)
Show SMILES Cc1cccc(c1)-c1ccc(NC[C@@H](N)CS)cc1
Show InChI InChI=1S/C16H20N2S/c1-12-3-2-4-14(9-12)13-5-7-16(8-6-13)18-10-15(17)11-19/h2-9,15,18-19H,10-11,17H2,1H3/t15-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Geranylgeranyl transferase type I


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048951
PNG
(3'-[((R)-2-Amino-3-mercapto-propionylamino)-methyl...)
Show SMILES N[C@@H](CS)C(=O)NCc1cccc(c1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C17H18N2O3S/c18-15(10-23)16(20)19-9-11-3-1-4-12(7-11)13-5-2-6-14(8-13)17(21)22/h1-8,15,23H,9-10,18H2,(H,19,20)(H,21,22)/t15-/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Geranylgeranyl transferase type I


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048953
PNG
(4'-((R)-2-Amino-3-mercapto-propylamino)-biphenyl-3...)
Show SMILES N[C@@H](CS)CNc1ccc(cc1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C16H18N2O2S/c17-14(10-21)9-18-15-6-4-11(5-7-15)12-2-1-3-13(8-12)16(19)20/h1-8,14,18,21H,9-10,17H2,(H,19,20)/t14-/m1/s1
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n/an/a 1.00E+5n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Geranylgeranyl transferase type I


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048957
PNG
(4'-((R)-2-Amino-3-mercapto-propionylamino)-bipheny...)
Show SMILES N[C@@H](CS)C(=O)Nc1ccc(cc1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C16H16N2O3S/c17-14(9-22)15(19)18-13-6-4-10(5-7-13)11-2-1-3-12(8-11)16(20)21/h1-8,14,22H,9,17H2,(H,18,19)(H,20,21)/t14-/m0/s1
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n/an/a 1.00E+5n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Geranylgeranyl transferase type I


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048959
PNG
(4'-((R)-2-Amino-3-mercapto-propylamino)-biphenyl-4...)
Show SMILES N[C@@H](CS)CNc1ccc(cc1)-c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C16H18N2O2S/c17-14(10-21)9-18-15-7-5-12(6-8-15)11-1-3-13(4-2-11)16(19)20/h1-8,14,18,21H,9-10,17H2,(H,19,20)/t14-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Geranylgeranyl transferase type I


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048951
PNG
(3'-[((R)-2-Amino-3-mercapto-propionylamino)-methyl...)
Show SMILES N[C@@H](CS)C(=O)NCc1cccc(c1)-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C17H18N2O3S/c18-15(10-23)16(20)19-9-11-3-1-4-12(7-11)13-5-2-6-14(8-13)17(21)22/h1-8,15,23H,9-10,18H2,(H,19,20)(H,21,22)/t15-/m0/s1
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n/an/a 1.00E+5n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Farnesyltransferase


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
Geranylgeranyl transferase type-1 subunit beta/Protein farnesyltransferase/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50048952
PNG
(4'-((R)-2-Amino-3-mercapto-propylamino)-biphenyl-2...)
Show SMILES N[C@@H](CS)CNc1ccc(cc1)-c1ccccc1C(O)=O
Show InChI InChI=1S/C16H18N2O2S/c17-12(10-21)9-18-13-7-5-11(6-8-13)14-3-1-2-4-15(14)16(19)20/h1-8,12,18,21H,9-10,17H2,(H,19,20)/t12-/m1/s1
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n/an/a 1.40E+5n/an/an/an/an/an/a



University of Pittsburgh

Curated by ChEMBL


Assay Description
In vitro inhibition of Geranylgeranyl transferase type I


J Med Chem 39: 217-23 (1996)


Article DOI: 10.1021/jm950414g
BindingDB Entry DOI: 10.7270/Q23J3DM7
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%