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Compile Data Set for Download or QSAR

Found 96 hits with Last Name = 'shuler' and Initial = 'kr'   
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


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060140
PNG
(CHEMBL115943 | [(S)-1-{(4-Benzyloxy-benzyl)-[(2-cy...)
Show SMILES O=C(CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)NCC(C#N)c1ccccc1
Show InChI InChI=1S/C39H38N6O5/c40-21-33(32-14-8-3-9-15-32)22-42-37(46)25-45(24-29-16-18-35(19-17-29)49-26-30-10-4-1-5-11-30)38(47)36(20-34-23-41-28-43-34)44-39(48)50-27-31-12-6-2-7-13-31/h1-19,23,28,33,36H,20,22,24-27H2,(H,41,43)(H,42,46)(H,44,48)/t33?,36-/m0/s1
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n/an/a 2n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060144
PNG
(CHEMBL325073 | [(S)-1-{(4-Benzyloxy-benzyl)-[((R)-...)
Show SMILES C[C@H](Cc1ccccc1)NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C39H41N5O5/c1-29(21-30-11-5-2-6-12-30)42-37(45)25-44(24-31-17-19-35(20-18-31)48-26-32-13-7-3-8-14-32)38(46)36(22-34-23-40-28-41-34)43-39(47)49-27-33-15-9-4-10-16-33/h2-20,23,28-29,36H,21-22,24-27H2,1H3,(H,40,41)(H,42,45)(H,43,47)/t29-,36+/m1/s1
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n/an/a 3n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055595
PNG
(CHEMBL304691 | [(R)-1-((R)-2-(4-Benzyloxy-phenyl)-...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CS)NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C47H51N9O8S/c1-29(42(48)57)52-43(58)39(21-33-23-50-37-15-9-8-14-36(33)37)54-46(61)41(27-65)55-44(59)38(20-30-16-18-35(19-17-30)63-25-31-10-4-2-5-11-31)53-45(60)40(22-34-24-49-28-51-34)56-47(62)64-26-32-12-6-3-7-13-32/h2-19,23-24,28-29,38-41,50,65H,20-22,25-27H2,1H3,(H2,48,57)(H,49,51)(H,52,58)(H,53,60)(H,54,61)(H,55,59)(H,56,62)/t29-,38+,39+,40+,41+/m0/s1
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n/an/a 4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060141
PNG
(CHEMBL431440 | [(S)-1-{(4-Benzyloxy-benzyl)-[(2-me...)
Show SMILES CC(C)(CNC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)c1ccccc1
Show InChI InChI=1S/C40H43N5O5/c1-40(2,33-16-10-5-11-17-33)28-42-37(46)25-45(24-30-18-20-35(21-19-30)49-26-31-12-6-3-7-13-31)38(47)36(22-34-23-41-29-43-34)44-39(48)50-27-32-14-8-4-9-15-32/h3-21,23,29,36H,22,24-28H2,1-2H3,(H,41,43)(H,42,46)(H,44,48)/t36-/m0/s1
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n/an/a 4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060149
PNG
(CHEMBL112512 | [(S)-1-{(4-Benzyloxy-benzyl)-[(2-ph...)
Show SMILES CCC(CNC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)c1ccccc1
Show InChI InChI=1S/C40H43N5O5/c1-2-33(34-16-10-5-11-17-34)23-42-38(46)26-45(25-30-18-20-36(21-19-30)49-27-31-12-6-3-7-13-31)39(47)37(22-35-24-41-29-43-35)44-40(48)50-28-32-14-8-4-9-15-32/h3-21,24,29,33,37H,2,22-23,25-28H2,1H3,(H,41,43)(H,42,46)(H,44,48)/t33?,37-/m0/s1
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n/an/a 5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060145
PNG
(CHEMBL115669 | [(S)-1-{(4-Benzyloxy-benzyl)-[((S)-...)
Show SMILES C[C@H](CNC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)c1ccccc1
Show InChI InChI=1S/C39H41N5O5/c1-29(33-15-9-4-10-16-33)22-41-37(45)25-44(24-30-17-19-35(20-18-30)48-26-31-11-5-2-6-12-31)38(46)36(21-34-23-40-28-42-34)43-39(47)49-27-32-13-7-3-8-14-32/h2-20,23,28-29,36H,21-22,24-27H2,1H3,(H,40,42)(H,41,45)(H,43,47)/t29-,36+/m1/s1
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n/an/a 5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060139
PNG
(CHEMBL326352 | [(S)-1-((4-Benzyloxy-benzyl)-{[(1-p...)
Show SMILES O=C(CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)NCC1(CCC1)c1ccccc1
Show InChI InChI=1S/C41H43N5O5/c47-38(43-29-41(21-10-22-41)34-15-8-3-9-16-34)26-46(25-31-17-19-36(20-18-31)50-27-32-11-4-1-5-12-32)39(48)37(23-35-24-42-30-44-35)45-40(49)51-28-33-13-6-2-7-14-33/h1-9,11-20,24,30,37H,10,21-23,25-29H2,(H,42,44)(H,43,47)(H,45,49)/t37-/m0/s1
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n/an/a 6n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055604
PNG
(CHEMBL441189 | [(R)-1-[(R)-1-{(R)-2-Benzyloxy-1-[(...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C47H52N9O12P/c1-29(42(48)57)52-43(58)39(21-33-23-50-37-15-9-8-14-36(33)37)54-46(61)41(27-66-25-31-10-4-2-5-11-31)55-44(59)38(20-30-16-18-35(19-17-30)68-69(63,64)65)53-45(60)40(22-34-24-49-28-51-34)56-47(62)67-26-32-12-6-3-7-13-32/h2-19,23-24,28-29,38-41,50H,20-22,25-27H2,1H3,(H2,48,57)(H,49,51)(H,52,58)(H,53,60)(H,54,61)(H,55,59)(H,56,62)(H2,63,64,65)/t29-,38+,39+,40+,41+/m0/s1
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n/an/a 6n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of rat brain farnesyltransferase in 50 mM HEPES buffer


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060146
PNG
(CHEMBL407445 | [(S)-1-((4-Benzyloxy-benzyl)-{[(1-p...)
Show SMILES O=C(CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)NCC1(CC1)c1ccccc1
Show InChI InChI=1S/C40H41N5O5/c46-37(42-28-40(20-21-40)33-14-8-3-9-15-33)25-45(24-30-16-18-35(19-17-30)49-26-31-10-4-1-5-11-31)38(47)36(22-34-23-41-29-43-34)44-39(48)50-27-32-12-6-2-7-13-32/h1-19,23,29,36H,20-22,24-28H2,(H,41,43)(H,42,46)(H,44,48)/t36-/m0/s1
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n/an/a 7n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060138
PNG
(CHEMBL324827 | [(S)-1-{(4-Benzyloxy-benzyl)-[(2-ph...)
Show SMILES CC(CNC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)c1ccccc1
Show InChI InChI=1S/C39H41N5O5/c1-29(33-15-9-4-10-16-33)22-41-37(45)25-44(24-30-17-19-35(20-18-30)48-26-31-11-5-2-6-12-31)38(46)36(21-34-23-40-28-42-34)43-39(47)49-27-32-13-7-3-8-14-32/h2-20,23,28-29,36H,21-22,24-27H2,1H3,(H,40,42)(H,41,45)(H,43,47)/t29?,36-/m0/s1
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n/an/a 8n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055633
PNG
(CHEMBL384416 | [(R)-1-[(R)-1-{(R)-2-Benzyloxy-1-[(...)
Show SMILES CC(NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C54H57N9O9/c1-35(49(55)64)59-50(65)46(26-40-28-57-44-20-12-11-19-43(40)44)61-53(68)48(33-70-30-37-13-5-2-6-14-37)62-51(66)45(25-36-21-23-42(24-22-36)71-31-38-15-7-3-8-16-38)60-52(67)47(27-41-29-56-34-58-41)63-54(69)72-32-39-17-9-4-10-18-39/h2-24,28-29,34-35,45-48,57H,25-27,30-33H2,1H3,(H2,55,64)(H,56,58)(H,59,65)(H,60,67)(H,61,68)(H,62,66)(H,63,69)/t35?,45-,46-,47-,48-/m1/s1
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n/an/a 8.5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50408250
PNG
(CHEMBL2115092)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](COCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C47H51N9O8/c1-30(42(48)57)52-43(58)39(22-34-24-50-37-20-12-11-19-36(34)37)54-46(61)41(28-63-26-32-15-7-3-8-16-32)55-44(59)38(21-31-13-5-2-6-14-31)53-45(60)40(23-35-25-49-29-51-35)56-47(62)64-27-33-17-9-4-10-18-33/h2-20,24-25,29-30,38-41,50H,21-23,26-28H2,1H3,(H2,48,57)(H,49,51)(H,52,58)(H,53,60)(H,54,61)(H,55,59)(H,56,62)/t30-,38+,39+,40+,41+/m1/s1
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n/an/a 9n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055604
PNG
(CHEMBL441189 | [(R)-1-[(R)-1-{(R)-2-Benzyloxy-1-[(...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C47H52N9O12P/c1-29(42(48)57)52-43(58)39(21-33-23-50-37-15-9-8-14-36(33)37)54-46(61)41(27-66-25-31-10-4-2-5-11-31)55-44(59)38(20-30-16-18-35(19-17-30)68-69(63,64)65)53-45(60)40(22-34-24-49-28-51-34)56-47(62)67-26-32-12-6-3-7-13-32/h2-19,23-24,28-29,38-41,50H,20-22,25-27H2,1H3,(H2,48,57)(H,49,51)(H,52,58)(H,53,60)(H,54,61)(H,55,59)(H,56,62)(H2,63,64,65)/t29-,38+,39+,40+,41+/m0/s1
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n/an/a 9n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of rat brain farnesyltransferase in 5 mM potassium phosphate and 50 mM HEPES buffer


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Homo sapiens (Human))
BDBM50059876
PNG
(CHEMBL217423 | [(S)-1-[(S)-1-{(S)-2-Benzyloxy-1-[(...)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](COCc1ccccc1)NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C54H57N9O9/c1-35(49(55)64)59-50(65)46(26-40-28-57-44-20-12-11-19-43(40)44)61-53(68)48(33-70-30-37-13-5-2-6-14-37)62-51(66)45(25-36-21-23-42(24-22-36)71-31-38-15-7-3-8-16-38)60-52(67)47(27-41-29-56-34-58-41)63-54(69)72-32-39-17-9-4-10-18-39/h2-24,28-29,34-35,45-48,57H,25-27,30-33H2,1H3,(H2,55,64)(H,56,58)(H,59,65)(H,60,67)(H,61,68)(H,62,66)(H,63,69)/t35-,45+,46+,47+,48+/m1/s1
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n/an/a 10n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of human farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055604
PNG
(CHEMBL441189 | [(R)-1-[(R)-1-{(R)-2-Benzyloxy-1-[(...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C47H52N9O12P/c1-29(42(48)57)52-43(58)39(21-33-23-50-37-15-9-8-14-36(33)37)54-46(61)41(27-66-25-31-10-4-2-5-11-31)55-44(59)38(20-30-16-18-35(19-17-30)68-69(63,64)65)53-45(60)40(22-34-24-49-28-51-34)56-47(62)67-26-32-12-6-3-7-13-32/h2-19,23-24,28-29,38-41,50H,20-22,25-27H2,1H3,(H2,48,57)(H,49,51)(H,52,58)(H,53,60)(H,54,61)(H,55,59)(H,56,62)(H2,63,64,65)/t29-,38+,39+,40+,41+/m0/s1
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n/an/a 13n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of rat brain farnesyltransferase in 30 mM potassium phosphate buffer


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50369314
PNG
(CHEMBL1790438)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)[C@@H](C)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C55H59N9O9/c1-35(50(56)65)60-51(66)47(27-41-29-58-45-21-13-12-20-44(41)45)62-54(69)49(36(2)71-31-38-14-6-3-7-15-38)64-53(68)46(26-37-22-24-43(25-23-37)72-32-39-16-8-4-9-17-39)61-52(67)48(28-42-30-57-34-59-42)63-55(70)73-33-40-18-10-5-11-19-40/h3-25,29-30,34-36,46-49,58H,26-28,31-33H2,1-2H3,(H2,56,65)(H,57,59)(H,60,66)(H,61,67)(H,62,69)(H,63,70)(H,64,68)/t35-,36+,46+,47+,48+,49+/m0/s1
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n/an/a 15n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055631
PNG
(CHEMBL429183 | [(R)-1-((R)-2-(4-Benzyloxy-phenyl)-...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](CSCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C54H57N9O8S/c1-35(49(55)64)59-50(65)46(26-40-28-57-44-20-12-11-19-43(40)44)61-53(68)48(33-72-32-39-17-9-4-10-18-39)62-51(66)45(25-36-21-23-42(24-22-36)70-30-37-13-5-2-6-14-37)60-52(67)47(27-41-29-56-34-58-41)63-54(69)71-31-38-15-7-3-8-16-38/h2-24,28-29,34-35,45-48,57H,25-27,30-33H2,1H3,(H2,55,64)(H,56,58)(H,59,65)(H,60,67)(H,61,68)(H,62,66)(H,63,69)/t35-,45+,46+,47+,48+/m0/s1
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n/an/a 15n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060150
PNG
(CHEMBL114281 | [(S)-1-{(4-Benzyloxy-benzyl)-[((R)-...)
Show SMILES C[C@@H](CNC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)c1ccccc1
Show InChI InChI=1S/C39H41N5O5/c1-29(33-15-9-4-10-16-33)22-41-37(45)25-44(24-30-17-19-35(20-18-30)48-26-31-11-5-2-6-12-31)38(46)36(21-34-23-40-28-42-34)43-39(47)49-27-32-13-7-3-8-14-32/h2-20,23,28-29,36H,21-22,24-27H2,1H3,(H,40,42)(H,41,45)(H,43,47)/t29-,36-/m0/s1
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n/an/a 16n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060142
PNG
(CHEMBL326127 | [(S)-1-((4-Benzyloxy-benzyl)-{[(1-p...)
Show SMILES O=C(CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)NCC1(CCCC1)c1ccccc1
Show InChI InChI=1S/C42H45N5O5/c48-39(44-30-42(22-10-11-23-42)35-16-8-3-9-17-35)27-47(26-32-18-20-37(21-19-32)51-28-33-12-4-1-5-13-33)40(49)38(24-36-25-43-31-45-36)46-41(50)52-29-34-14-6-2-7-15-34/h1-9,12-21,25,31,38H,10-11,22-24,26-30H2,(H,43,45)(H,44,48)(H,46,50)/t38-/m0/s1
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n/an/a 17n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055613
PNG
(CHEMBL436158 | [(R)-1-((R)-1-{(R)-2-Benzyloxy-1-[(...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](CCc1ccccc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C48H53N9O8/c1-31(43(49)58)53-45(60)40(23-35-25-51-38-20-12-11-19-37(35)38)55-47(62)42(29-64-27-33-15-7-3-8-16-33)56-44(59)39(22-21-32-13-5-2-6-14-32)54-46(61)41(24-36-26-50-30-52-36)57-48(63)65-28-34-17-9-4-10-18-34/h2-20,25-26,30-31,39-42,51H,21-24,27-29H2,1H3,(H2,49,58)(H,50,52)(H,53,60)(H,54,61)(H,55,62)(H,56,59)(H,57,63)/t31-,39+,40+,41+,42+/m0/s1
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n/an/a 18n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055636
PNG
(4-{(R)-2-Benzyloxy-1-[(R)-1-((S)-1-carbamoyl-ethyl...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)C(CCC(O)=O)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C43H49N9O10/c1-26(38(44)55)48-40(57)34(18-29-20-46-32-15-9-8-14-31(29)32)50-42(59)36(24-61-22-27-10-4-2-5-11-27)51-39(56)33(16-17-37(53)54)49-41(58)35(19-30-21-45-25-47-30)52-43(60)62-23-28-12-6-3-7-13-28/h2-15,20-21,25-26,33-36,46H,16-19,22-24H2,1H3,(H2,44,55)(H,45,47)(H,48,57)(H,49,58)(H,50,59)(H,51,56)(H,52,60)(H,53,54)/t26-,33?,34+,35+,36+/m0/s1
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n/an/a 18n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50059876
PNG
(CHEMBL217423 | [(S)-1-[(S)-1-{(S)-2-Benzyloxy-1-[(...)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](COCc1ccccc1)NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C54H57N9O9/c1-35(49(55)64)59-50(65)46(26-40-28-57-44-20-12-11-19-43(40)44)61-53(68)48(33-70-30-37-13-5-2-6-14-37)62-51(66)45(25-36-21-23-42(24-22-36)71-31-38-15-7-3-8-16-38)60-52(67)47(27-41-29-56-34-58-41)63-54(69)72-32-39-17-9-4-10-18-39/h2-24,28-29,34-35,45-48,57H,25-27,30-33H2,1H3,(H2,55,64)(H,56,58)(H,59,65)(H,60,67)(H,61,68)(H,62,66)(H,63,69)/t35-,45+,46+,47+,48+/m1/s1
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n/an/a 20n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of rat brain farnesyltransferase in 30 mM potassium phosphate buffer


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50059876
PNG
(CHEMBL217423 | [(S)-1-[(S)-1-{(S)-2-Benzyloxy-1-[(...)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](COCc1ccccc1)NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C54H57N9O9/c1-35(49(55)64)59-50(65)46(26-40-28-57-44-20-12-11-19-43(40)44)61-53(68)48(33-70-30-37-13-5-2-6-14-37)62-51(66)45(25-36-21-23-42(24-22-36)71-31-38-15-7-3-8-16-38)60-52(67)47(27-41-29-56-34-58-41)63-54(69)72-32-39-17-9-4-10-18-39/h2-24,28-29,34-35,45-48,57H,25-27,30-33H2,1H3,(H2,55,64)(H,56,58)(H,59,65)(H,60,67)(H,61,68)(H,62,66)(H,63,69)/t35-,45+,46+,47+,48+/m1/s1
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n/an/a 20n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055614
PNG
((4-{2-{(R)-2-Benzyloxy-1-[(R)-1-((S)-1-carbamoyl-e...)
Show SMILES CCOP(=O)(Cc1ccc(CC(NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)C(=O)N[C@H](COCc2ccccc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)C(N)=O)cc1)OCC
Show InChI InChI=1S/C52H62N9O11P/c1-4-71-73(68,72-5-2)32-38-22-20-35(21-23-38)24-43(58-50(65)45(26-40-28-54-33-56-40)61-52(67)70-30-37-16-10-7-11-17-37)49(64)60-46(31-69-29-36-14-8-6-9-15-36)51(66)59-44(48(63)57-34(3)47(53)62)25-39-27-55-42-19-13-12-18-41(39)42/h6-23,27-28,33-34,43-46,55H,4-5,24-26,29-32H2,1-3H3,(H2,53,62)(H,54,56)(H,57,63)(H,58,65)(H,59,66)(H,60,64)(H,61,67)/t34-,43?,44+,45+,46+/m0/s1
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n/an/a 25n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of rat brain farnesyltransferase in 30 mM potassium phosphate buffer


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060148
PNG
(CHEMBL325331 | [(S)-1-{(4-Benzyloxy-benzyl)-[(2-ph...)
Show SMILES CCCC(CNC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)c1ccccc1
Show InChI InChI=1S/C41H45N5O5/c1-2-12-35(34-17-10-5-11-18-34)24-43-39(47)27-46(26-31-19-21-37(22-20-31)50-28-32-13-6-3-7-14-32)40(48)38(23-36-25-42-30-44-36)45-41(49)51-29-33-15-8-4-9-16-33/h3-11,13-22,25,30,35,38H,2,12,23-24,26-29H2,1H3,(H,42,44)(H,43,47)(H,45,49)/t35?,38-/m0/s1
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n/an/a 25n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Bos taurus (bovine))
BDBM13373
PNG
((2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpro...)
Show SMILES CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CS)C(C)C)C(O)=O |r|
Show InChI InChI=1S/C22H34N4O5S2/c1-13(2)18(26-19(27)15(23)12-32)21(29)25-17(11-14-7-5-4-6-8-14)20(28)24-16(22(30)31)9-10-33-3/h4-8,13,15-18,32H,9-12,23H2,1-3H3,(H,24,28)(H,25,29)(H,26,27)(H,30,31)/t15-,16-,17-,18-/m0/s1
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n/an/a 25n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of bovine Farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060152
PNG
(CHEMBL112879 | [(S)-1-{(4-Benzyloxy-benzyl)-[(2-et...)
Show SMILES CCC(CC)(CNC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)c1ccccc1
Show InChI InChI=1S/C42H47N5O5/c1-3-42(4-2,35-18-12-7-13-19-35)30-44-39(48)27-47(26-32-20-22-37(23-21-32)51-28-33-14-8-5-9-15-33)40(49)38(24-36-25-43-31-45-36)46-41(50)52-29-34-16-10-6-11-17-34/h5-23,25,31,38H,3-4,24,26-30H2,1-2H3,(H,43,45)(H,44,48)(H,46,50)/t38-/m0/s1
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n/an/a 32n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50408252
PNG
(CHEMBL2115488)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](COCc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C47H51N9O9/c1-29(42(48)58)52-43(59)39(21-33-23-50-37-15-9-8-14-36(33)37)54-46(62)41(27-64-25-31-10-4-2-5-11-31)55-44(60)38(20-30-16-18-35(57)19-17-30)53-45(61)40(22-34-24-49-28-51-34)56-47(63)65-26-32-12-6-3-7-13-32/h2-19,23-24,28-29,38-41,50,57H,20-22,25-27H2,1H3,(H2,48,58)(H,49,51)(H,52,59)(H,53,61)(H,54,62)(H,55,60)(H,56,63)/t29-,38+,39+,40+,41+/m1/s1
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n/an/a 35n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of rat brain farnesyltransferase in 30 mM potassium phosphate buffer


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50408252
PNG
(CHEMBL2115488)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](COCc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C47H51N9O9/c1-29(42(48)58)52-43(59)39(21-33-23-50-37-15-9-8-14-36(33)37)54-46(62)41(27-64-25-31-10-4-2-5-11-31)55-44(60)38(20-30-16-18-35(57)19-17-30)53-45(61)40(22-34-24-49-28-51-34)56-47(63)65-26-32-12-6-3-7-13-32/h2-19,23-24,28-29,38-41,50,57H,20-22,25-27H2,1H3,(H2,48,58)(H,49,51)(H,52,59)(H,53,61)(H,54,62)(H,55,60)(H,56,63)/t29-,38+,39+,40+,41+/m1/s1
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n/an/a 35n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055624
PNG
(CHEMBL428836 | [(S)-1-[(R)-1-{(R)-2-Benzyloxy-1-[(...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C54H57N9O9/c1-35(49(55)64)59-50(65)46(26-40-28-57-44-20-12-11-19-43(40)44)61-53(68)48(33-70-30-37-13-5-2-6-14-37)62-51(66)45(25-36-21-23-42(24-22-36)71-31-38-15-7-3-8-16-38)60-52(67)47(27-41-29-56-34-58-41)63-54(69)72-32-39-17-9-4-10-18-39/h2-24,28-29,34-35,45-48,57H,25-27,30-33H2,1H3,(H2,55,64)(H,56,58)(H,59,65)(H,60,67)(H,61,68)(H,62,66)(H,63,69)/t35-,45+,46+,47-,48+/m0/s1
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n/an/a 35n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055617
PNG
(CHEMBL2373058 | N-{(R)-2-Benzyloxy-1-[(R)-1-((S)-1...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](Cc1c[nH]cn1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C42H47N9O10/c1-25(37(43)54)47-38(55)32(16-28-19-45-31-15-9-8-14-30(28)31)48-41(58)35(23-60-21-26-10-4-2-5-11-26)50-40(57)34(18-36(52)53)49-39(56)33(17-29-20-44-24-46-29)51-42(59)61-22-27-12-6-3-7-13-27/h2-15,19-20,24-25,32-35,45H,16-18,21-23H2,1H3,(H2,43,54)(H,44,46)(H,47,55)(H,48,58)(H,49,56)(H,50,57)(H,51,59)(H,52,53)/t25-,32+,33+,34-,35+/m0/s1
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n/an/a 38n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50060143
PNG
(CHEMBL324345 | [(S)-1-{(4-Benzyloxy-benzyl)-[((S)-...)
Show SMILES C[C@@H](Cc1ccccc1)NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C39H41N5O5/c1-29(21-30-11-5-2-6-12-30)42-37(45)25-44(24-31-17-19-35(20-18-31)48-26-32-13-7-3-8-14-32)38(46)36(22-34-23-40-28-41-34)43-39(47)49-27-33-15-9-4-10-16-33/h2-20,23,28-29,36H,21-22,24-27H2,1H3,(H,40,41)(H,42,45)(H,43,47)/t29-,36-/m0/s1
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n/an/a 41n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055594
PNG
((S)-2-[(R)-2-{(R)-3-Benzyloxy-2-[(R)-2-[(R)-2-benz...)
Show SMILES COC(=O)[C@H](C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C55H58N8O10/c1-36(54(68)70-2)59-50(64)47(27-41-29-57-45-21-13-12-20-44(41)45)61-53(67)49(34-71-31-38-14-6-3-7-15-38)62-51(65)46(26-37-22-24-43(25-23-37)72-32-39-16-8-4-9-17-39)60-52(66)48(28-42-30-56-35-58-42)63-55(69)73-33-40-18-10-5-11-19-40/h3-25,29-30,35-36,46-49,57H,26-28,31-34H2,1-2H3,(H,56,58)(H,59,64)(H,60,66)(H,61,67)(H,62,65)(H,63,69)/t36-,46+,47+,48+,49+/m0/s1
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n/an/a 48n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055630
PNG
((S)-2-[(R)-2-{(R)-3-Benzyloxy-2-[(R)-2-[(R)-2-benz...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(O)=O
Show InChI InChI=1S/C54H56N8O10/c1-35(53(67)68)58-49(63)46(26-40-28-56-44-20-12-11-19-43(40)44)60-52(66)48(33-70-30-37-13-5-2-6-14-37)61-50(64)45(25-36-21-23-42(24-22-36)71-31-38-15-7-3-8-16-38)59-51(65)47(27-41-29-55-34-57-41)62-54(69)72-32-39-17-9-4-10-18-39/h2-24,28-29,34-35,45-48,56H,25-27,30-33H2,1H3,(H,55,57)(H,58,63)(H,59,65)(H,60,66)(H,61,64)(H,62,69)(H,67,68)/t35-,45+,46+,47+,48+/m0/s1
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n/an/a 48n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055614
PNG
((4-{2-{(R)-2-Benzyloxy-1-[(R)-1-((S)-1-carbamoyl-e...)
Show SMILES CCOP(=O)(Cc1ccc(CC(NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)C(=O)N[C@H](COCc2ccccc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)C(N)=O)cc1)OCC
Show InChI InChI=1S/C52H62N9O11P/c1-4-71-73(68,72-5-2)32-38-22-20-35(21-23-38)24-43(58-50(65)45(26-40-28-54-33-56-40)61-52(67)70-30-37-16-10-7-11-17-37)49(64)60-46(31-69-29-36-14-8-6-9-15-36)51(66)59-44(48(63)57-34(3)47(53)62)25-39-27-55-42-19-13-12-18-41(39)42/h6-23,27-28,33-34,43-46,55H,4-5,24-26,29-32H2,1-3H3,(H2,53,62)(H,54,56)(H,57,63)(H,58,65)(H,59,66)(H,60,64)(H,61,67)/t34-,43?,44+,45+,46+/m0/s1
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n/an/a 49n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of rat brain farnesyltransferase in 5 mM potassium phosphate and 50 mM HEPES buffer


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055621
PNG
(CHEMBL294750 | [(R)-1-(1-{(R)-2-Benzyloxy-1-[(R)-1...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)C(CCC(N)=O)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C43H50N10O9/c1-26(38(45)55)49-40(57)34(18-29-20-47-32-15-9-8-14-31(29)32)51-42(59)36(24-61-22-27-10-4-2-5-11-27)52-39(56)33(16-17-37(44)54)50-41(58)35(19-30-21-46-25-48-30)53-43(60)62-23-28-12-6-3-7-13-28/h2-15,20-21,25-26,33-36,47H,16-19,22-24H2,1H3,(H2,44,54)(H2,45,55)(H,46,48)(H,49,57)(H,50,58)(H,51,59)(H,52,56)(H,53,60)/t26-,33?,34+,35+,36+/m0/s1
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n/an/a 54n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50059857
PNG
(CHEMBL102955 | [(S)-1-[(4-Benzyloxy-benzyl)-(phene...)
Show SMILES O=C(CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)NCCc1ccccc1
Show InChI InChI=1S/C38H39N5O5/c44-36(40-21-20-29-10-4-1-5-11-29)25-43(24-30-16-18-34(19-17-30)47-26-31-12-6-2-7-13-31)37(45)35(22-33-23-39-28-41-33)42-38(46)48-27-32-14-8-3-9-15-32/h1-19,23,28,35H,20-22,24-27H2,(H,39,41)(H,40,44)(H,42,46)/t35-/m0/s1
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n/an/a 62n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055635
PNG
(CHEMBL264915 | [(R)-1-[(R)-1-{(R)-2-Benzyloxy-1-[(...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(=O)NN
Show InChI InChI=1S/C54H58N10O9/c1-35(49(65)64-55)59-50(66)46(26-40-28-57-44-20-12-11-19-43(40)44)61-53(69)48(33-71-30-37-13-5-2-6-14-37)62-51(67)45(25-36-21-23-42(24-22-36)72-31-38-15-7-3-8-16-38)60-52(68)47(27-41-29-56-34-58-41)63-54(70)73-32-39-17-9-4-10-18-39/h2-24,28-29,34-35,45-48,57H,25-27,30-33,55H2,1H3,(H,56,58)(H,59,66)(H,60,68)(H,61,69)(H,62,67)(H,63,70)(H,64,65)/t35-,45+,46+,47+,48+/m0/s1
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n/an/a 64n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055629
PNG
(CHEMBL62202 | [(R)-1-(1-{(R)-2-Benzyloxy-1-[(R)-1-...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)C(CC1CCCCC1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C47H57N9O8/c1-30(42(48)57)52-43(58)39(22-34-24-50-37-20-12-11-19-36(34)37)54-46(61)41(28-63-26-32-15-7-3-8-16-32)55-44(59)38(21-31-13-5-2-6-14-31)53-45(60)40(23-35-25-49-29-51-35)56-47(62)64-27-33-17-9-4-10-18-33/h3-4,7-12,15-20,24-25,29-31,38-41,50H,2,5-6,13-14,21-23,26-28H2,1H3,(H2,48,57)(H,49,51)(H,52,58)(H,53,60)(H,54,61)(H,55,59)(H,56,62)/t30-,38?,39+,40+,41+/m0/s1
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n/an/a 66n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055614
PNG
((4-{2-{(R)-2-Benzyloxy-1-[(R)-1-((S)-1-carbamoyl-e...)
Show SMILES CCOP(=O)(Cc1ccc(CC(NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)OCc2ccccc2)C(=O)N[C@H](COCc2ccccc2)C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](C)C(N)=O)cc1)OCC
Show InChI InChI=1S/C52H62N9O11P/c1-4-71-73(68,72-5-2)32-38-22-20-35(21-23-38)24-43(58-50(65)45(26-40-28-54-33-56-40)61-52(67)70-30-37-16-10-7-11-17-37)49(64)60-46(31-69-29-36-14-8-6-9-15-36)51(66)59-44(48(63)57-34(3)47(53)62)25-39-27-55-42-19-13-12-18-41(39)42/h6-23,27-28,33-34,43-46,55H,4-5,24-26,29-32H2,1-3H3,(H2,53,62)(H,54,56)(H,57,63)(H,58,65)(H,59,66)(H,60,64)(H,61,67)/t34-,43?,44+,45+,46+/m0/s1
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n/an/a 75n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of rat brain farnesyltransferase in 50 mM HEPES buffer


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50059876
PNG
(CHEMBL217423 | [(S)-1-[(S)-1-{(S)-2-Benzyloxy-1-[(...)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](COCc1ccccc1)NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C54H57N9O9/c1-35(49(55)64)59-50(65)46(26-40-28-57-44-20-12-11-19-43(40)44)61-53(68)48(33-70-30-37-13-5-2-6-14-37)62-51(66)45(25-36-21-23-42(24-22-36)71-31-38-15-7-3-8-16-38)60-52(67)47(27-41-29-56-34-58-41)63-54(69)72-32-39-17-9-4-10-18-39/h2-24,28-29,34-35,45-48,57H,25-27,30-33H2,1H3,(H2,55,64)(H,56,58)(H,59,65)(H,60,67)(H,61,68)(H,62,66)(H,63,69)/t35-,45+,46+,47+,48+/m1/s1
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n/an/a 76n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of rat brain farnesyltransferase in 5 mM potassium phosphate and 50 mM HEPES buffer


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50059876
PNG
(CHEMBL217423 | [(S)-1-[(S)-1-{(S)-2-Benzyloxy-1-[(...)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](COCc1ccccc1)NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C54H57N9O9/c1-35(49(55)64)59-50(65)46(26-40-28-57-44-20-12-11-19-43(40)44)61-53(68)48(33-70-30-37-13-5-2-6-14-37)62-51(66)45(25-36-21-23-42(24-22-36)71-31-38-15-7-3-8-16-38)60-52(67)47(27-41-29-56-34-58-41)63-54(69)72-32-39-17-9-4-10-18-39/h2-24,28-29,34-35,45-48,57H,25-27,30-33H2,1H3,(H2,55,64)(H,56,58)(H,59,65)(H,60,67)(H,61,68)(H,62,66)(H,63,69)/t35-,45+,46+,47+,48+/m1/s1
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n/an/a 76n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
In vitro inhibition of rat farnesyltransferase.


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50408253
PNG
(CHEMBL2115486)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C47H51N9O8/c1-30(42(48)57)52-43(58)39(22-34-24-50-37-20-12-11-19-36(34)37)54-46(61)41(28-63-26-32-15-7-3-8-16-32)55-44(59)38(21-31-13-5-2-6-14-31)53-45(60)40(23-35-25-49-29-51-35)56-47(62)64-27-33-17-9-4-10-18-33/h2-20,24-25,29-30,38-41,50H,21-23,26-28H2,1H3,(H2,48,57)(H,49,51)(H,52,58)(H,53,60)(H,54,61)(H,55,59)(H,56,62)/t30-,38-,39+,40+,41+/m1/s1
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n/an/a 79n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055626
PNG
(CHEMBL216670 | [1-[(R)-1-{(R)-2-Benzyloxy-1-[(R)-1...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)C(Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C54H57N9O9/c1-35(49(55)64)59-50(65)46(26-40-28-57-44-20-12-11-19-43(40)44)61-53(68)48(33-70-30-37-13-5-2-6-14-37)62-51(66)45(25-36-21-23-42(24-22-36)71-31-38-15-7-3-8-16-38)60-52(67)47(27-41-29-56-34-58-41)63-54(69)72-32-39-17-9-4-10-18-39/h2-24,28-29,34-35,45-48,57H,25-27,30-33H2,1H3,(H2,55,64)(H,56,58)(H,59,65)(H,60,67)(H,61,68)(H,62,66)(H,63,69)/t35-,45+,46+,47?,48+/m0/s1
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n/an/a 82n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
GTPase HRas


(Homo sapiens (Human))
BDBM50060139
PNG
(CHEMBL326352 | [(S)-1-((4-Benzyloxy-benzyl)-{[(1-p...)
Show SMILES O=C(CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)NCC1(CCC1)c1ccccc1
Show InChI InChI=1S/C41H43N5O5/c47-38(43-29-41(21-10-22-41)34-15-8-3-9-16-34)26-46(25-31-17-19-36(20-18-31)50-27-32-11-4-1-5-12-32)39(48)37(23-35-24-42-30-44-35)45-40(49)51-28-33-13-6-2-7-14-33/h1-9,11-20,24,30,37H,10,21-23,25-29H2,(H,42,44)(H,43,47)(H,45,49)/t37-/m0/s1
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n/an/a 88n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Concentration required to inhibit 50% of the cultured colonies of H-Ras-Fcells .


J Med Chem 40: 3319-22 (1997)


Article DOI: 10.1021/jm970470c
BindingDB Entry DOI: 10.7270/Q2V69HQG
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50408252
PNG
(CHEMBL2115488)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](COCc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C47H51N9O9/c1-29(42(48)58)52-43(59)39(21-33-23-50-37-15-9-8-14-36(33)37)54-46(62)41(27-64-25-31-10-4-2-5-11-31)55-44(60)38(20-30-16-18-35(57)19-17-30)53-45(61)40(22-34-24-49-28-51-34)56-47(63)65-26-32-12-6-3-7-13-32/h2-19,23-24,28-29,38-41,50,57H,20-22,25-27H2,1H3,(H2,48,58)(H,49,51)(H,52,59)(H,53,61)(H,54,62)(H,55,60)(H,56,63)/t29-,38+,39+,40+,41+/m1/s1
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n/an/a 102n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of rat brain farnesyltransferase in 5 mM potassium phosphate and 50 mM HEPES buffer


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055623
PNG
(CHEMBL262497 | [(R)-1-((R)-2-(4-Benzyloxy-phenyl)-...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(Cc1ccccc1)NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C53H55N9O8/c1-34(48(54)63)58-49(64)46(27-39-29-56-43-20-12-11-19-42(39)43)61-51(66)44(25-35-13-5-2-6-14-35)59-50(65)45(26-36-21-23-41(24-22-36)69-31-37-15-7-3-8-16-37)60-52(67)47(28-40-30-55-33-57-40)62-53(68)70-32-38-17-9-4-10-18-38/h2-24,29-30,33-34,44-47,56H,25-28,31-32H2,1H3,(H2,54,63)(H,55,57)(H,58,64)(H,59,65)(H,60,67)(H,61,66)(H,62,68)/t34-,44?,45+,46+,47+/m0/s1
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n/an/a 130n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055611
PNG
(CHEMBL302620 | {1-[(R)-1-{(R)-2-Benzyloxy-1-[(R)-1...)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)C(CS)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C51H55N7O9S/c1-33(46(52)59)54-47(60)43(26-38-27-53-41-20-12-11-19-40(38)41)56-49(62)44(31-65-28-35-13-5-2-6-14-35)57-48(61)42(25-34-21-23-39(24-22-34)66-29-36-15-7-3-8-16-36)55-50(63)45(32-68)58-51(64)67-30-37-17-9-4-10-18-37/h2-24,27,33,42-45,53,68H,25-26,28-32H2,1H3,(H2,52,59)(H,54,60)(H,55,63)(H,56,62)(H,57,61)(H,58,64)/t33-,42+,43+,44+,45?/m0/s1
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n/an/a 170n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50408251
PNG
(CHEMBL2115094)
Show SMILES C[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(N)=O
Show InChI InChI=1S/C47H51N9O9/c1-29(42(48)58)52-43(59)39(21-33-23-50-37-15-9-8-14-36(33)37)54-46(62)41(27-64-25-31-10-4-2-5-11-31)55-44(60)38(20-30-16-18-35(57)19-17-30)53-45(61)40(22-34-24-49-28-51-34)56-47(63)65-26-32-12-6-3-7-13-32/h2-19,23-24,28-29,38-41,50,57H,20-22,25-27H2,1H3,(H2,48,58)(H,49,51)(H,52,59)(H,53,61)(H,54,62)(H,55,60)(H,56,63)/t29-,38-,39+,40+,41+/m1/s1
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n/an/a 170n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha


(Rattus norvegicus-Rattus norvegicus (rat))
BDBM50055627
PNG
(CHEMBL268158 | [(R)-1-[(R)-1-{(R)-2-Benzyloxy-1-[(...)
Show SMILES CCNC(=O)[C@H](C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](COCc1ccccc1)NC(=O)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C56H61N9O9/c1-3-58-51(66)37(2)61-52(67)48(28-42-30-59-46-22-14-13-21-45(42)46)63-55(70)50(35-72-32-39-15-7-4-8-16-39)64-53(68)47(27-38-23-25-44(26-24-38)73-33-40-17-9-5-10-18-40)62-54(69)49(29-43-31-57-36-60-43)65-56(71)74-34-41-19-11-6-12-20-41/h4-26,30-31,36-37,47-50,59H,3,27-29,32-35H2,1-2H3,(H,57,60)(H,58,66)(H,61,67)(H,62,69)(H,63,70)(H,64,68)(H,65,71)/t37-,47+,48+,49+,50+/m0/s1
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n/an/a 170n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain farnesyltransferase


J Med Chem 40: 192-200 (1997)


Article DOI: 10.1021/jm960602m
BindingDB Entry DOI: 10.7270/Q2JW8FJ4
More data for this
Ligand-Target Pair
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