Found 36 hits Enz. Inhib. hit(s) with all data for entry = 50018964 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
GTPase KRas
(Homo sapiens (Human)) | BDBM50614269
(CHEMBL5273122)Show SMILES Oc1cc(-c2ncc3c(nc(OC[C@@]45CCCN4C[C@H](F)C5)nc3c2F)N2CCCC3(CCO3)C2)c2c(C#C)c(F)ccc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| | n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614262
(CHEMBL5276699)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CC(=O)N4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614261
(CHEMBL5289987)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CC(O)CC4(CC4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614265
(CHEMBL5267786)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CNC(=O)O4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614264
(CHEMBL5286301)Show SMILES CCc1cccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CC(O)C4)C3)c12 |r,wU:27.28,wD:21.20,(-4.59,2.41,;-4.59,.87,;-5.92,.1,;-7.26,.85,;-8.58,.07,;-8.57,-1.47,;-7.24,-2.23,;-7.24,-3.76,;-5.9,-4.53,;-5.9,-6.07,;-4.57,-3.76,;-4.57,-2.22,;-3.24,-1.45,;-3.24,.09,;-1.9,.86,;-.57,.1,;.76,.86,;2.09,.09,;2.09,-1.44,;3.43,-2.21,;4.76,-1.44,;6.14,-2.12,;5.09,-3.23,;5.8,-4.6,;7.28,-4.35,;7.52,-2.8,;8.58,-1.69,;7.87,-.32,;8.55,1.07,;6.38,-.57,;.77,-2.22,;-.57,-1.44,;-1.9,-2.21,;-1.9,-3.75,;.76,2.4,;-.58,3.17,;-.58,4.71,;.76,5.48,;2.09,4.71,;3.42,3.94,;4.21,5.3,;5.69,5.7,;2.87,6.07,;2.09,3.17,;-5.91,-1.45,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614271
(CHEMBL5265862)Show SMILES Oc1cc(-c2ncc3c(nc(OC[C@@]45CCCN4C[C@H](F)C5)nc3c2F)N2CCC[C@]3(CCO3)C2)c2c(Cl)c(F)ccc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614271
(CHEMBL5265862)Show SMILES Oc1cc(-c2ncc3c(nc(OC[C@@]45CCCN4C[C@H](F)C5)nc3c2F)N2CCC[C@]3(CCO3)C2)c2c(Cl)c(F)ccc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614270
(CHEMBL5290459)Show SMILES Oc1cc(Cl)c(C2CC2)c(c1)-c1ncc2c(nc(OC[C@@]34CCCN3C[C@H](F)C4)nc2c1F)N1CCCC2(CCO2)C1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614269
(CHEMBL5273122)Show SMILES Oc1cc(-c2ncc3c(nc(OC[C@@]45CCCN4C[C@H](F)C5)nc3c2F)N2CCCC3(CCO3)C2)c2c(C#C)c(F)ccc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614268
(CHEMBL5269272)Show SMILES Oc1cc(-c2ncc3c(nc(OC[C@@]45CCCN4C[C@H](F)C5)nc3c2F)N2CCCC3(CCO3)C2)c2c(F)c(F)ccc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614265
(CHEMBL5267786)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CNC(=O)O4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614262
(CHEMBL5276699)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CC(=O)N4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614261
(CHEMBL5289987)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CC(O)CC4(CC4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614270
(CHEMBL5290459)Show SMILES Oc1cc(Cl)c(C2CC2)c(c1)-c1ncc2c(nc(OC[C@@]34CCCN3C[C@H](F)C4)nc2c1F)N1CCCC2(CCO2)C1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614267
(CHEMBL5279657)Show SMILES CCc1cccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CCO4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614268
(CHEMBL5269272)Show SMILES Oc1cc(-c2ncc3c(nc(OC[C@@]45CCCN4C[C@H](F)C5)nc3c2F)N2CCCC3(CCO3)C2)c2c(F)c(F)ccc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614263
(CHEMBL5286121)Show SMILES OC1CC2(C1)CCCN(C2)c1nc(OC[C@@]23CCCN2C[C@H](F)C3)nc2c(F)c(ncc12)-c1cc(O)cc2ccc(F)c(F)c12 |r,wU:21.24,wD:15.16,(5.69,5.7,;4.21,5.3,;3.42,3.94,;2.09,4.71,;2.87,6.07,;.76,5.48,;-.58,4.71,;-.58,3.17,;.76,2.4,;2.09,3.17,;.76,.86,;2.09,.09,;2.09,-1.44,;3.43,-2.21,;4.76,-1.44,;6.14,-2.12,;5.09,-3.23,;5.8,-4.6,;7.28,-4.35,;7.52,-2.8,;8.58,-1.69,;7.87,-.32,;8.55,1.07,;6.38,-.57,;.76,-2.22,;-.57,-1.44,;-1.9,-2.21,;-1.9,-3.75,;-3.24,-1.45,;-3.24,.09,;-1.9,.86,;-.57,.09,;-4.57,-2.22,;-4.57,-3.76,;-5.9,-4.53,;-5.9,-6.07,;-7.24,-3.76,;-7.24,-2.23,;-8.57,-1.47,;-8.58,.07,;-7.26,.85,;-7.26,2.39,;-5.92,.1,;-4.59,.87,;-5.91,-1.45,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614264
(CHEMBL5286301)Show SMILES CCc1cccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CC(O)C4)C3)c12 |r,wU:27.28,wD:21.20,(-4.59,2.41,;-4.59,.87,;-5.92,.1,;-7.26,.85,;-8.58,.07,;-8.57,-1.47,;-7.24,-2.23,;-7.24,-3.76,;-5.9,-4.53,;-5.9,-6.07,;-4.57,-3.76,;-4.57,-2.22,;-3.24,-1.45,;-3.24,.09,;-1.9,.86,;-.57,.1,;.76,.86,;2.09,.09,;2.09,-1.44,;3.43,-2.21,;4.76,-1.44,;6.14,-2.12,;5.09,-3.23,;5.8,-4.6,;7.28,-4.35,;7.52,-2.8,;8.58,-1.69,;7.87,-.32,;8.55,1.07,;6.38,-.57,;.77,-2.22,;-.57,-1.44,;-1.9,-2.21,;-1.9,-3.75,;.76,2.4,;-.58,3.17,;-.58,4.71,;.76,5.48,;2.09,4.71,;3.42,3.94,;4.21,5.3,;5.69,5.7,;2.87,6.07,;2.09,3.17,;-5.91,-1.45,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614263
(CHEMBL5286121)Show SMILES OC1CC2(C1)CCCN(C2)c1nc(OC[C@@]23CCCN2C[C@H](F)C3)nc2c(F)c(ncc12)-c1cc(O)cc2ccc(F)c(F)c12 |r,wU:21.24,wD:15.16,(5.69,5.7,;4.21,5.3,;3.42,3.94,;2.09,4.71,;2.87,6.07,;.76,5.48,;-.58,4.71,;-.58,3.17,;.76,2.4,;2.09,3.17,;.76,.86,;2.09,.09,;2.09,-1.44,;3.43,-2.21,;4.76,-1.44,;6.14,-2.12,;5.09,-3.23,;5.8,-4.6,;7.28,-4.35,;7.52,-2.8,;8.58,-1.69,;7.87,-.32,;8.55,1.07,;6.38,-.57,;.76,-2.22,;-.57,-1.44,;-1.9,-2.21,;-1.9,-3.75,;-3.24,-1.45,;-3.24,.09,;-1.9,.86,;-.57,.09,;-4.57,-2.22,;-4.57,-3.76,;-5.9,-4.53,;-5.9,-6.07,;-7.24,-3.76,;-7.24,-2.23,;-8.57,-1.47,;-8.58,.07,;-7.26,.85,;-7.26,2.39,;-5.92,.1,;-4.59,.87,;-5.91,-1.45,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614266
(CHEMBL5279240)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CCO4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614267
(CHEMBL5279657)Show SMILES CCc1cccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CCO4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614266
(CHEMBL5279240)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CCO4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614271
(CHEMBL5265862)Show SMILES Oc1cc(-c2ncc3c(nc(OC[C@@]45CCCN4C[C@H](F)C5)nc3c2F)N2CCC[C@]3(CCO3)C2)c2c(Cl)c(F)ccc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614266
(CHEMBL5279240)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CCO4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614272
(CHEMBL5275926)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3C)N3CCCC4(CCO4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614272
(CHEMBL5275926)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3C)N3CCCC4(CCO4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614268
(CHEMBL5269272)Show SMILES Oc1cc(-c2ncc3c(nc(OC[C@@]45CCCN4C[C@H](F)C5)nc3c2F)N2CCCC3(CCO3)C2)c2c(F)c(F)ccc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614272
(CHEMBL5275926)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3C)N3CCCC4(CCO4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614267
(CHEMBL5279657)Show SMILES CCc1cccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CCO4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614264
(CHEMBL5286301)Show SMILES CCc1cccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CC(O)C4)C3)c12 |r,wU:27.28,wD:21.20,(-4.59,2.41,;-4.59,.87,;-5.92,.1,;-7.26,.85,;-8.58,.07,;-8.57,-1.47,;-7.24,-2.23,;-7.24,-3.76,;-5.9,-4.53,;-5.9,-6.07,;-4.57,-3.76,;-4.57,-2.22,;-3.24,-1.45,;-3.24,.09,;-1.9,.86,;-.57,.1,;.76,.86,;2.09,.09,;2.09,-1.44,;3.43,-2.21,;4.76,-1.44,;6.14,-2.12,;5.09,-3.23,;5.8,-4.6,;7.28,-4.35,;7.52,-2.8,;8.58,-1.69,;7.87,-.32,;8.55,1.07,;6.38,-.57,;.77,-2.22,;-.57,-1.44,;-1.9,-2.21,;-1.9,-3.75,;.76,2.4,;-.58,3.17,;-.58,4.71,;.76,5.48,;2.09,4.71,;3.42,3.94,;4.21,5.3,;5.69,5.7,;2.87,6.07,;2.09,3.17,;-5.91,-1.45,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614265
(CHEMBL5267786)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CNC(=O)O4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614261
(CHEMBL5289987)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CC(O)CC4(CC4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614269
(CHEMBL5273122)Show SMILES Oc1cc(-c2ncc3c(nc(OC[C@@]45CCCN4C[C@H](F)C5)nc3c2F)N2CCCC3(CCO3)C2)c2c(C#C)c(F)ccc2c1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614262
(CHEMBL5276699)Show SMILES CCc1c(F)ccc2cc(O)cc(-c3ncc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CCCC4(CC(=O)N4)C3)c12 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 44 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614270
(CHEMBL5290459)Show SMILES Oc1cc(Cl)c(C2CC2)c(c1)-c1ncc2c(nc(OC[C@@]34CCCN3C[C@H](F)C4)nc2c1F)N1CCCC2(CCO2)C1 |r| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 66 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
GTPase KRas
(Homo sapiens (Human)) | BDBM50614263
(CHEMBL5286121)Show SMILES OC1CC2(C1)CCCN(C2)c1nc(OC[C@@]23CCCN2C[C@H](F)C3)nc2c(F)c(ncc12)-c1cc(O)cc2ccc(F)c(F)c12 |r,wU:21.24,wD:15.16,(5.69,5.7,;4.21,5.3,;3.42,3.94,;2.09,4.71,;2.87,6.07,;.76,5.48,;-.58,4.71,;-.58,3.17,;.76,2.4,;2.09,3.17,;.76,.86,;2.09,.09,;2.09,-1.44,;3.43,-2.21,;4.76,-1.44,;6.14,-2.12,;5.09,-3.23,;5.8,-4.6,;7.28,-4.35,;7.52,-2.8,;8.58,-1.69,;7.87,-.32,;8.55,1.07,;6.38,-.57,;.76,-2.22,;-.57,-1.44,;-1.9,-2.21,;-1.9,-3.75,;-3.24,-1.45,;-3.24,.09,;-1.9,.86,;-.57,.09,;-4.57,-2.22,;-4.57,-3.76,;-5.9,-4.53,;-5.9,-6.07,;-7.24,-3.76,;-7.24,-2.23,;-8.57,-1.47,;-8.58,.07,;-7.26,.85,;-7.26,2.39,;-5.92,.1,;-4.59,.87,;-5.91,-1.45,)| | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 119 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
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