BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 50 hits Enz. Inhib. hit(s) with Target = 'Ha-Ras-CVLS' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50089960
PNG
(5-{4-[Bis-(2-chloro-ethyl)-amino]-benzoylamino}-1H...)
Show SMILES Cn1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)c4nc5ccc(NC(=O)c6ccc(cc6)N(CCCl)CCCl)cc5[nH]4)cn3C)cn2C)cc1C(=O)NCCC(N)=N
Show InChI InChI=1S/C40H43Cl2N13O5/c1-52-20-25(17-31(52)37(57)45-13-10-34(43)44)47-38(58)32-18-26(21-53(32)2)48-39(59)33-19-27(22-54(33)3)49-40(60)35-50-29-9-6-24(16-30(29)51-35)46-36(56)23-4-7-28(8-5-23)55(14-11-41)15-12-42/h4-9,16-22H,10-15H2,1-3H3,(H3,43,44)(H,45,57)(H,46,56)(H,47,58)(H,48,59)(H,49,60)(H,50,51)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 15n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Tested for 50% inhibition of generation of Human Ha-ras polymerase chain reaction(PCR) products


J Med Chem 43: 2675-84 (2000)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50089962
PNG
(5-{4-[Bis-(2-chloro-ethyl)-amino]-benzoylamino}-be...)
Show SMILES Cn1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)c4cc5cc(NC(=O)c6ccc(cc6)N(CCCl)CCCl)ccc5o4)cn3C)cn2C)cc1C(=O)NCCC(N)=N
Show InChI InChI=1S/C41H43Cl2N11O6/c1-51-21-27(18-31(51)38(56)46-13-10-36(44)45)48-39(57)32-19-28(22-52(32)2)49-40(58)33-20-29(23-53(33)3)50-41(59)35-17-25-16-26(6-9-34(25)60-35)47-37(55)24-4-7-30(8-5-24)54(14-11-42)15-12-43/h4-9,16-23H,10-15H2,1-3H3,(H3,44,45)(H,46,56)(H,47,55)(H,48,57)(H,49,58)(H,50,59)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 15n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Tested for 50% inhibition of generation of Human Ha-ras polymerase chain reaction(PCR) products


J Med Chem 43: 2675-84 (2000)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50089967
PNG
(5-{4-[Bis-(2-chloro-ethyl)-amino]-benzoylamino}-1H...)
Show SMILES Cn1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)c4cc5cc(NC(=O)c6ccc(cc6)N(CCCl)CCCl)ccc5[nH]4)cn3C)cn2C)cc1C(=O)NCCC(N)=N
Show InChI InChI=1S/C41H44Cl2N12O5/c1-52-22-28(18-33(52)39(58)46-13-10-36(44)45)49-41(60)35-20-29(23-54(35)3)50-40(59)34-19-27(21-53(34)2)48-38(57)32-17-25-16-26(6-9-31(25)51-32)47-37(56)24-4-7-30(8-5-24)55(14-11-42)15-12-43/h4-9,16-23,51H,10-15H2,1-3H3,(H3,44,45)(H,46,58)(H,47,56)(H,48,57)(H,49,60)(H,50,59)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 15n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Tested for 50% inhibition of generation of Human Ha-ras polymerase chain reaction(PCR) products


J Med Chem 43: 2675-84 (2000)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50089961
PNG
(5-{4-[Bis-(2-chloro-ethyl)-amino]-benzoylamino}-1-...)
Show SMILES Cn1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)c4cc5cc(NC(=O)c6ccc(cc6)N(CCCl)CCCl)ccc5n4C)cn3C)cn2C)cc1C(=O)NCCC(N)=N
Show InChI InChI=1S/C42H46Cl2N12O5/c1-52-22-28(19-33(52)39(58)47-14-11-37(45)46)49-40(59)34-20-29(23-53(34)2)50-41(60)35-21-30(24-54(35)3)51-42(61)36-18-26-17-27(7-10-32(26)55(36)4)48-38(57)25-5-8-31(9-6-25)56(15-12-43)16-13-44/h5-10,17-24H,11-16H2,1-4H3,(H3,45,46)(H,47,58)(H,48,57)(H,49,59)(H,50,60)(H,51,61)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 15n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Tested for 50% inhibition of generation of Human Ha-ras polymerase chain reaction(PCR) products


J Med Chem 43: 2675-84 (2000)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50089969
PNG
(5-[Bis-(2-chloro-ethyl)-amino]-benzofuran-2-carbox...)
Show SMILES Cn1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)c4cc5cc(ccc5o4)N(CCCl)CCCl)cn3C)cn2C)cc1C(=O)NCCC(N)=N
Show InChI InChI=1S/C34H38Cl2N10O5/c1-43-17-21(14-25(43)31(47)39-9-6-30(37)38)40-32(48)26-15-22(18-44(26)2)41-33(49)27-16-23(19-45(27)3)42-34(50)29-13-20-12-24(4-5-28(20)51-29)46(10-7-35)11-8-36/h4-5,12-19H,6-11H2,1-3H3,(H3,37,38)(H,39,47)(H,40,48)(H,41,49)(H,42,50)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 15n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Tested for 50% inhibition of generation of Human Ha-ras polymerase chain reaction(PCR) products


J Med Chem 43: 2675-84 (2000)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50089971
PNG
(5-[Bis-(2-chloro-ethyl)-amino]-1-methyl-1H-indole-...)
Show SMILES Cn1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)c4cc5cc(ccc5n4C)N(CCCl)CCCl)cn3C)cn2C)cc1C(=O)NCCC(N)=N
Show InChI InChI=1S/C35H41Cl2N11O4/c1-44-18-22(15-27(44)32(49)40-10-7-31(38)39)41-33(50)28-16-23(19-45(28)2)42-34(51)29-17-24(20-46(29)3)43-35(52)30-14-21-13-25(5-6-26(21)47(30)4)48(11-8-36)12-9-37/h5-6,13-20H,7-12H2,1-4H3,(H3,38,39)(H,40,49)(H,41,50)(H,42,51)(H,43,52)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 20n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Tested for 50% inhibition of generation of Human Ha-ras polymerase chain reaction(PCR) products


J Med Chem 43: 2675-84 (2000)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50089978
PNG
(5-[Bis-(2-chloro-ethyl)-amino]-1H-indole-2-carboxy...)
Show SMILES Cn1cc(NC(=O)c2cc(NC(=O)c3cc(NC(=O)c4cc5cc(ccc5[nH]4)N(CCCl)CCCl)cn3C)cn2C)cc1C(=O)NCCC(N)=N
Show InChI InChI=1S/C34H39Cl2N11O4/c1-44-18-22(14-27(44)32(49)39-9-6-30(37)38)41-34(51)29-16-23(19-46(29)3)42-33(50)28-15-21(17-45(28)2)40-31(48)26-13-20-12-24(4-5-25(20)43-26)47(10-7-35)11-8-36/h4-5,12-19,43H,6-11H2,1-3H3,(H3,37,38)(H,39,49)(H,40,48)(H,41,51)(H,42,50)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 20n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Tested for 50% inhibition of generation of Human Ha-ras polymerase chain reaction(PCR) products


J Med Chem 43: 2675-84 (2000)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a 180n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a 180n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 190n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50055659
PNG
(2N-(3,3-aminoiminopropyl)-4-[4-(4-formamido-1-meth...)
Show SMILES Cn1cc(NC=O)cc1C(=O)Nc1cc(C(=O)Nc2cc(C(=O)NCCC(N)=N)n(C)c2)n(C)c1
Show InChI InChI=1S/C22H27N9O4/c1-29-9-13(26-12-32)6-17(29)21(34)28-15-8-18(31(3)11-15)22(35)27-14-7-16(30(2)10-14)20(33)25-5-4-19(23)24/h6-12H,4-5H2,1-3H3,(H3,23,24)(H,25,33)(H,26,32)(H,27,35)(H,28,34)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

AffyNet 
PubMed
n/an/a 200n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Tested for 50% inhibition of generation of Human Ha-ras polymerase chain reaction(PCR) products


J Med Chem 43: 2675-84 (2000)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 300n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a 310n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a 330n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 400n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 570n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 710n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287960
PNG
(1-[(2R,6S)-6-(tert-Butyl-dimethyl-silanyloxymethyl...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@@H](CO[Si](C)(C)C(C)(C)C)O1)Sc1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C29H36ClN5O5SSi/c1-18-26-27(30)21-14-19(38-5)12-13-22(21)31-28(26)34(32-18)25-16-33(41-24-11-9-8-10-23(24)35(36)37)15-20(40-25)17-39-42(6,7)29(2,3)4/h8-14,20,25H,15-17H2,1-7H3/t20-,25+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 1.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a>1.00E+3n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a>1.00E+3n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287951
PNG
(3-[(3aS,4R,6R,6aR)-6-(4-Chloro-6-methoxy-3-methyl-...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@@H]1O[C@H](OC(O)CC(=O)c2ccccc2)[C@H]2OC(=S)O[C@@H]12
Show InChI InChI=1S/C26H22ClN3O7S/c1-12-19-20(27)15-10-14(33-2)8-9-16(15)28-23(19)30(29-12)24-21-22(36-26(38)35-21)25(37-24)34-18(32)11-17(31)13-6-4-3-5-7-13/h3-10,18,21-22,24-25,32H,11H2,1-2H3/t18?,21-,22+,24-,25+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 1.50E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287961
PNG
((E)-5-[(2R,6R)-6-(4-Chloro-6-methoxy-3-methyl-pyra...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@H](O1)C=CCC(C)=O)Sc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C27H26ClN5O5S/c1-16(34)5-4-6-20-14-31(39-21-10-7-18(8-11-21)33(35)36)15-24(38-20)32-27-25(17(2)30-32)26(28)22-13-19(37-3)9-12-23(22)29-27/h4,6-13,20,24H,5,14-15H2,1-3H3/t20-,24-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 3.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 4.30E+3n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287943
PNG
((E)-4-[(2R,6R)-6-(4-Chloro-6-methoxy-3-methyl-pyra...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@H](O1)C=CCC(=O)c1ccccc1)Sc1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C32H28ClN5O5S/c1-20-30-31(33)24-17-22(42-2)15-16-25(24)34-32(30)37(35-20)29-19-36(44-28-14-7-6-12-26(28)38(40)41)18-23(43-29)11-8-13-27(39)21-9-4-3-5-10-21/h3-12,14-17,23,29H,13,18-19H2,1-2H3/t23-,29-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 4.70E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287946
PNG
(1-[(2R,6S)-6-(tert-Butyl-dimethyl-silanyloxymethyl...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@@H](CO[Si](C)(C)C(C)(C)C)O1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C29H36ClN5O7SSi/c1-18-26-27(30)23-14-20(40-5)10-13-24(23)31-28(26)34(32-18)25-16-33(15-21(42-25)17-41-44(6,7)29(2,3)4)43(38,39)22-11-8-19(9-12-22)35(36)37/h8-14,21,25H,15-17H2,1-7H3/t21-,25+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 5.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
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
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 6.30E+3n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287963
PNG
(CHEMBL300769 | [(2S,6R)-6-(4-Chloro-6-methoxy-3-me...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@@H](CO)O1)Sc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C23H22ClN5O5S/c1-13-21-22(24)18-9-15(33-2)5-8-19(18)25-23(21)28(26-13)20-11-27(10-16(12-30)34-20)35-17-6-3-14(4-7-17)29(31)32/h3-9,16,20,30H,10-12H2,1-2H3/t16-,20+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 6.70E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287959
PNG
((E)-4-[(2R,6R)-6-(4-Chloro-6-methoxy-3-methyl-pyra...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@H](O1)C=CCC(=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C32H28ClN5O7S/c1-20-30-31(33)26-17-23(44-2)13-16-27(26)34-32(30)37(35-20)29-19-36(46(42,43)25-14-11-22(12-15-25)38(40)41)18-24(45-29)9-6-10-28(39)21-7-4-3-5-8-21/h3-9,11-17,24,29H,10,18-19H2,1-2H3/t24-,29-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 7.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287955
PNG
((E)-4-[(2R,6R)-6-(4-Chloro-6-methoxy-3-methyl-pyra...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@H](O1)C=CCC(=O)c1ccccc1)Sc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C32H28ClN5O5S/c1-20-30-31(33)26-17-23(42-2)13-16-27(26)34-32(30)37(35-20)29-19-36(44-25-14-11-22(12-15-25)38(40)41)18-24(43-29)9-6-10-28(39)21-7-4-3-5-8-21/h3-9,11-17,24,29H,10,18-19H2,1-2H3/t24-,29-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 7.40E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50072339
PNG
(Benzodiazepine-Distamycin Hybrid | CHEMBL102341)
Show SMILES COc1cc2c(cc1OCCC(=O)Nc1cc(C(=O)Nc3cc(C(=O)Nc4cc(C(=O)NCCC(N)=N)n(C)c4)n(C)c3)n(C)c1)N=C[C@@H]1CCCN1C2=O
Show InChI InChI=1S/C37H43N11O7/c1-45-19-22(13-27(45)34(50)40-9-7-32(38)39)43-36(52)29-14-23(20-47(29)3)44-35(51)28-12-21(18-46(28)2)42-33(49)8-11-55-31-16-26-25(15-30(31)54-4)37(53)48-10-5-6-24(48)17-41-26/h12-20,24H,5-11H2,1-4H3,(H3,38,39)(H,40,50)(H,42,49)(H,43,52)(H,44,51)/t24-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 8.00E+3n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Inhibition of Ha-ras polymerase-chain reaction product


Bioorg Med Chem Lett 8: 3019-24 (1999)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287958
PNG
(CHEMBL303105 | [(2S,6R)-6-(4-Chloro-6-methoxy-3-me...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@@H](CO)O1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C23H22ClN5O7S/c1-13-21-22(24)18-9-15(35-2)5-8-19(18)25-23(21)28(26-13)20-11-27(10-16(12-30)36-20)37(33,34)17-6-3-14(4-7-17)29(31)32/h3-9,16,20,30H,10-12H2,1-2H3/t16-,20+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 8.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287945
PNG
(5-(4-chloro-6-methoxy-3-methyl-1H-pyrazolo[3,4-b]q...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1
Show InChI InChI=1S/C38H30ClN3O8/c1-22-30-31(39)27-20-26(46-2)18-19-28(27)40-34(30)42(41-22)35-33(50-38(45)25-16-10-5-11-17-25)32(49-37(44)24-14-8-4-9-15-24)29(48-35)21-47-36(43)23-12-6-3-7-13-23/h3-20,29,32-33,35H,21H2,1-2H3/t29-,32-,33-,35-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro for inhibition of nucleotide exchange process of oncogenic Ras


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287944
PNG
((E)-3-[(2S,3S,4R,5R)-5-(4-Chloro-6-methoxy-3-methy...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@@H]1O[C@H](O\C=C\C(=O)c2ccccc2)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C25H22ClN3O6/c1-13-19-20(26)16-12-15(33-2)8-9-17(16)27-23(19)29(28-13)24-21(31)22(32)25(35-24)34-11-10-18(30)14-6-4-3-5-7-14/h3-12,21-22,24-25,31-32H,1-2H3/b11-10+/t21-,22+,24-,25+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287953
PNG
(5-(4-chloro-6-methoxy-3-methyl-1H-pyrazolo[3,4-b]q...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@@H]1O[C@H](COC(=O)c2ccco2)[C@@H](OC(=O)c2ccco2)[C@H]1OC(=O)c1ccco1
Show InChI InChI=1S/C32H24ClN3O11/c1-16-24-25(33)18-14-17(40-2)9-10-19(18)34-28(24)36(35-16)29-27(47-32(39)22-8-5-13-43-22)26(46-31(38)21-7-4-12-42-21)23(45-29)15-44-30(37)20-6-3-11-41-20/h3-14,23,26-27,29H,15H2,1-2H3/t23-,26-,27-,29-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 1.05E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287962
PNG
(CHEMBL61870 | [(2S,6R)-4-Benzenesulfonyl-6-(4-chlo...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@@H](CO)O1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C23H23ClN4O5S/c1-14-21-22(24)18-10-15(32-2)8-9-19(18)25-23(21)28(26-14)20-12-27(11-16(13-29)33-20)34(30,31)17-6-4-3-5-7-17/h3-10,16,20,29H,11-13H2,1-2H3/t16-,20+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 1.20E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287949
PNG
(1-[(2R,6S)-4-Benzenesulfonyl-6-(tert-butyl-dimethy...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@@H](CO[Si](C)(C)C(C)(C)C)O1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C29H37ClN4O5SSi/c1-19-26-27(30)23-15-20(37-5)13-14-24(23)31-28(26)34(32-19)25-17-33(40(35,36)22-11-9-8-10-12-22)16-21(39-25)18-38-41(6,7)29(2,3)4/h8-15,21,25H,16-18H2,1-7H3/t21-,25+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 1.40E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287948
PNG
(CHEMBL64886 | [(2S,6R)-6-(4-Chloro-6-methoxy-3-met...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@@H](CO)O1)Sc1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C23H22ClN5O5S/c1-13-21-22(24)16-9-14(33-2)7-8-17(16)25-23(21)28(26-13)20-11-27(10-15(12-30)34-20)35-19-6-4-3-5-18(19)29(31)32/h3-9,15,20,30H,10-12H2,1-2H3/t15-,20+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 1.40E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50059879
PNG
(CHEMBL102492 | [(S)-1-{(4-Benzyloxy-benzyl)-[(2-be...)
Show SMILES O=C(CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OCc1ccccc1)NCCOCc1ccccc1
Show InChI InChI=1S/C39H41N5O6/c45-37(41-20-21-48-26-31-10-4-1-5-11-31)25-44(24-30-16-18-35(19-17-30)49-27-32-12-6-2-7-13-32)38(46)36(22-34-23-40-29-42-34)43-39(47)50-28-33-14-8-3-9-15-33/h1-19,23,29,36H,20-22,24-28H2,(H,40,42)(H,41,45)(H,43,47)/t36-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a 1.43E+4n/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)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287956
PNG
(Benzoic acid (3aR,4R,6R,6aR)-6-(4-chloro-6-methoxy...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@H]2OC(=S)O[C@@H]12
Show InChI InChI=1S/C25H20ClN3O6S/c1-12-18-19(26)15-10-14(31-2)8-9-16(15)27-22(18)29(28-12)23-21-20(34-25(36)35-21)17(33-23)11-32-24(30)13-6-4-3-5-7-13/h3-10,17,20-21,23H,11H2,1-2H3/t17-,20-,21-,23-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 1.50E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287947
PNG
((E)-4-[(2R,6R)-6-(4-Chloro-6-methoxy-3-methyl-pyra...)
Show SMILES CCOC(=O)\C=C\C[C@@H]1CN(C[C@@H](O1)n1nc(C)c2c(Cl)c3cc(OC)ccc3nc12)Sc1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C28H28ClN5O6S/c1-4-39-25(35)11-7-8-19-15-32(41-23-10-6-5-9-22(23)34(36)37)16-24(40-19)33-28-26(17(2)31-33)27(29)20-14-18(38-3)12-13-21(20)30-28/h5-7,9-14,19,24H,4,8,15-16H2,1-3H3/b11-7+/t19-,24-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 1.60E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287952
PNG
(CHEMBL304717 | N-{4-[(2S,6R)-2-(tert-Butyl-dimethy...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@@H](CO[Si](C)(C)C(C)(C)C)O1)S(=O)(=O)c1ccc(NC(C)=O)cc1
Show InChI InChI=1S/C31H40ClN5O6SSi/c1-19-28-29(32)25-15-22(41-6)11-14-26(25)34-30(28)37(35-19)27-17-36(16-23(43-27)18-42-45(7,8)31(3,4)5)44(39,40)24-12-9-21(10-13-24)33-20(2)38/h9-15,23,27H,16-18H2,1-8H3,(H,33,38)/t23-,27+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 2.70E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287954
PNG
((E)-3-[(2S,5R)-5-(4-Chloro-6-methoxy-3-methyl-pyra...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@@H]1O[C@H](O\C=C\C(=O)c2ccccc2)C=C1
Show InChI InChI=1S/C25H20ClN3O4/c1-15-23-24(26)18-14-17(31-2)8-9-19(18)27-25(23)29(28-15)21-10-11-22(33-21)32-13-12-20(30)16-6-4-3-5-7-16/h3-14,21-22H,1-2H3/b13-12+/t21-,22+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
n/an/a 3.50E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287957
PNG
(1-[(2R,6S)-6-(tert-Butyl-dimethyl-silanyloxymethyl...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@H]1CN(C[C@@H](CO[Si](C)(C)C(C)(C)C)O1)Sc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C29H36ClN5O5SSi/c1-18-26-27(30)23-14-20(38-5)10-13-24(23)31-28(26)34(32-18)25-16-33(41-22-11-8-19(9-12-22)35(36)37)15-21(40-25)17-39-42(6,7)29(2,3)4/h8-14,21,25H,15-17H2,1-7H3/t21-,25+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
n/an/a 5.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50287950
PNG
(Benzoic acid (2S,5R)-5-(4-chloro-6-methoxy-3-methy...)
Show SMILES COc1ccc2nc3n(nc(C)c3c(Cl)c2c1)[C@@H]1O[C@H](COC(=O)c2ccccc2)C=C1
Show InChI InChI=1S/C24H20ClN3O4/c1-14-21-22(25)18-12-16(30-2)8-10-19(18)26-23(21)28(27-14)20-11-9-17(32-20)13-31-24(29)15-6-4-3-5-7-15/h3-12,17,20H,13H2,1-2H3/t17-,20+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
Article
n/an/a 8.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of nucleotide exchange process of oncogenic Ras in vitro


Bioorg Med Chem Lett 6: 195-200 (1996)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50055659
PNG
(2N-(3,3-aminoiminopropyl)-4-[4-(4-formamido-1-meth...)
Show SMILES Cn1cc(NC=O)cc1C(=O)Nc1cc(C(=O)Nc2cc(C(=O)NCCC(N)=N)n(C)c2)n(C)c1
Show InChI InChI=1S/C22H27N9O4/c1-29-9-13(26-12-32)6-17(29)21(34)28-15-8-18(31(3)11-15)22(35)27-14-7-16(30(2)10-14)20(33)25-5-4-19(23)24/h6-12H,4-5H2,1-3H3,(H3,23,24)(H,25,33)(H,26,32)(H,27,35)(H,28,34)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Inhibition of Ha-ras polymerase-chain reaction product


Bioorg Med Chem Lett 8: 3019-24 (1999)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50055659
PNG
(2N-(3,3-aminoiminopropyl)-4-[4-(4-formamido-1-meth...)
Show SMILES Cn1cc(NC=O)cc1C(=O)Nc1cc(C(=O)Nc2cc(C(=O)NCCC(N)=N)n(C)c2)n(C)c1
Show InChI InChI=1S/C22H27N9O4/c1-29-9-13(26-12-32)6-17(29)21(34)28-15-8-18(31(3)11-15)22(35)27-14-7-16(30(2)10-14)20(33)25-5-4-19(23)24/h6-12H,4-5H2,1-3H3,(H3,23,24)(H,25,33)(H,26,32)(H,27,35)(H,28,34)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Inhibition of Ha-ras polymerase-chain reaction product


Bioorg Med Chem Lett 8: 3019-24 (1999)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50072338
PNG
(3-((S)-7-Methoxy-5-oxo-2,3,5,11a-tetrahydro-1H-ben...)
Show SMILES COC(=O)CCOc1cc2N=C[C@@H]3CCCN3C(=O)c2cc1OC
Show InChI InChI=1S/C17H20N2O5/c1-22-14-8-12-13(9-15(14)24-7-5-16(20)23-2)18-10-11-4-3-6-19(11)17(12)21/h8-11H,3-7H2,1-2H3/t11-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a>3.00E+5n/an/an/an/an/an/a



Universit£ di Ferrara

Curated by ChEMBL


Assay Description
Inhibition of Ha-ras polymerase-chain reaction product


Bioorg Med Chem Lett 8: 3019-24 (1999)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50421182
PNG
(CHEMBL2086797)
Show SMILES CC[C@H](C)[C@H](NC(=O)CN1C\C=C/CCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(O)=O)C1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(N)=O
Show InChI InChI=1S/C92H142N22O27/c1-11-51(8)76(113-71(118)47-114-40-19-13-16-25-70(117)101-67(44-54-21-14-12-15-22-54)88(138)107-62(91(114)141)33-37-75(125)126)90(140)112-68(45-55-26-28-56(115)29-27-55)89(139)104-58(24-20-39-98-92(96)97)82(132)109-64(41-48(2)3)86(136)106-61(32-36-74(123)124)84(134)110-66(43-50(6)7)87(137)111-65(42-49(4)5)85(135)103-57(23-17-18-38-93)80(130)99-52(9)78(128)102-60(31-35-73(121)122)83(133)105-59(30-34-72(119)120)81(131)100-53(10)79(129)108-63(77(95)127)46-69(94)116/h12-15,19,21-22,26-29,48-53,57-68,76,115H,11,16-18,20,23-25,30-47,93H2,1-10H3,(H2,94,116)(H2,95,127)(H,99,130)(H,100,131)(H,101,117)(H,102,128)(H,103,135)(H,104,139)(H,105,133)(H,106,136)(H,107,138)(H,108,129)(H,109,132)(H,110,134)(H,111,137)(H,112,140)(H,113,118)(H,119,120)(H,121,122)(H,123,124)(H,125,126)(H4,96,97,98)/b19-13-/t51-,52-,53-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,76-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/an/a 2.80E+4n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to His6-tagged HRas expressed in Escherichia coli (BL21) by fluorescence polarization assay


Bioorg Med Chem Lett 22: 5766-76 (2012)

More data for this
Ligand-Target Pair
Ha-Ras-CVLS


(Homo sapiens (human))
BDBM50421182
PNG
(CHEMBL2086797)
Show SMILES CC[C@H](C)[C@H](NC(=O)CN1C\C=C/CCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CCC(O)=O)C1=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(N)=O
Show InChI InChI=1S/C92H142N22O27/c1-11-51(8)76(113-71(118)47-114-40-19-13-16-25-70(117)101-67(44-54-21-14-12-15-22-54)88(138)107-62(91(114)141)33-37-75(125)126)90(140)112-68(45-55-26-28-56(115)29-27-55)89(139)104-58(24-20-39-98-92(96)97)82(132)109-64(41-48(2)3)86(136)106-61(32-36-74(123)124)84(134)110-66(43-50(6)7)87(137)111-65(42-49(4)5)85(135)103-57(23-17-18-38-93)80(130)99-52(9)78(128)102-60(31-35-73(121)122)83(133)105-59(30-34-72(119)120)81(131)100-53(10)79(129)108-63(77(95)127)46-69(94)116/h12-15,19,21-22,26-29,48-53,57-68,76,115H,11,16-18,20,23-25,30-47,93H2,1-10H3,(H2,94,116)(H2,95,127)(H,99,130)(H,100,131)(H,101,117)(H,102,128)(H,103,135)(H,104,139)(H,105,133)(H,106,136)(H,107,138)(H,108,129)(H,109,132)(H,110,134)(H,111,137)(H,112,140)(H,113,118)(H,119,120)(H,121,122)(H,123,124)(H,125,126)(H4,96,97,98)/b19-13-/t51-,52-,53-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,76-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/an/a 1.58E+5n/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Binding affinity to His6-tagged HRas-GDP expressed in Escherichia coli (BL21) by fluorescence polarization assay


Bioorg Med Chem Lett 22: 5766-76 (2012)

More data for this
Ligand-Target Pair