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PDB: 12 results
8PI0
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with 5-(1H-indol-2-l)piperazin-2-one
Descriptor:
(5~{S})-5-(1~{H}-indol-2-yl)piperazin-2-one, V-Ki-ras2 Kirsten rat sarcoma viral oncogene homolog, isoform CRA_b
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-06-20
Release date:
2024-07-10
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
8PIY
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with (2E)-3-(1H-indol-2-yl)prop-2-enoic acid
Descriptor:
(~{E})-3-(1~{H}-indol-3-yl)prop-2-enoic acid, RASK GTPase (Fragment)
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-06-22
Release date:
2024-07-10
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
8QDS
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with N-(4-fluorophenyl)-2-(2-imino-1,3-thiazol-3-yl)acetamide
Descriptor:
2-(2-azanyl-1,3-thiazol-3-yl)-~{N}-(4-fluorophenyl)ethanamide, RASK GTPase (Fragment)
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-08-30
Release date:
2024-09-11
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
8QDP
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with N-[2-(5-fluoro-1H-indol-3-yl)ethyl]acetamide
Descriptor:
RASK GTPase (Fragment), ~{N}-[2-(5-fluoranyl-1~{H}-indol-3-yl)ethyl]ethanamide
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-08-30
Release date:
2024-09-11
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
8QE7
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with 2-(methylsulfonylmethyl)-1H-benzimidazole
Descriptor:
2-[(methylsulfonyl)methyl]-1H-benzimidazole, RASK GTPase (Fragment)
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-08-30
Release date:
2024-09-11
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
8QDK
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with N-(furan-2-ylmethyl)-1H-benzimidazol-2-amine
Descriptor:
N-[(furan-2-yl)methyl]-1H-benzimidazol-2-amine, RASK GTPase (Fragment)
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-08-29
Release date:
2024-09-11
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
8QEJ
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with 5-(1H-indol-2-yl)pyrrolidin-2-one
Descriptor:
(5~{S})-5-(1~{H}-indol-2-yl)pyrrolidin-2-one, RASK GTPase (Fragment)
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-08-31
Release date:
2024-09-11
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
8QDT
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with 2-fluoro-N-[(3-methyl-1H-pyrazol-4-yl)methyl]aniline
Descriptor:
2-fluoro-N-[(3-methyl-1H-pyrazol-4-yl)methyl]aniline, RASK GTPase (Fragment)
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-08-30
Release date:
2024-09-11
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
8QEI
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with N-(3-chlorophenyl)-2-pyrrolidin-1-ylacetamide
Descriptor:
RASK GTPase (Fragment), ~{N}-(3-chlorophenyl)-2-pyrrolidin-1-yl-ethanamide
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-08-31
Release date:
2024-09-11
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
8QDW
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with N-methyl-1-(1-phenylpyrazol-4-yl)methanamine
Descriptor:
N-methyl-1-(1-phenyl-1H-pyrazol-4-yl)methanamine, RASK GTPase (Fragment)
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-08-30
Release date:
2024-09-11
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
8QDN
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with7-fluoro-N,N-dimethyl-1-benzofuran-2-carboxamide
Descriptor:
7-fluoranyl-~{N},~{N}-dimethyl-1-benzofuran-2-carboxamide, RASK GTPase (Fragment)
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-08-30
Release date:
2024-10-16
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
8QE6
NMR2 Structure of KRAS G12V (GMPPNP bound) in complex with 1-(5-methoxy-1H-indol-3-yl)-N,N-dimethylmethanamine
Descriptor:
1-(5-methoxy-1H-indol-3-yl)-N,N-dimethyl-methanamine, RASK GTPase (Fragment)
Authors:
Buetikofer, M
,
Orts, J.
Deposit date:
2023-08-30
Release date:
2024-10-16
Last modified:
2025-05-07
Method:
SOLUTION NMR
Cite:
NMR2-Based Drug Discovery Pipeline Presented on the Oncogenic Protein KRAS.
J.Am.Chem.Soc., 147, 2025
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239149
數據於2025-07-23公開中