compound 2e [PMID: 19013076] [Ligand Id: 8830] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL106820
  • NG,NG-Dimethylarginine dimethylaminohydrolase 1/N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 in Human [ChEMBL: CHEMBL6036] [GtoPdb: 1247] [UniProtKB: O94760]
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  • Neuronal NOS/Nitric-oxide synthase, brain in Human [ChEMBL: CHEMBL3568] [GtoPdb: 1251] [UniProtKB: P29475]
  • Neuronal NOS/Nitric-oxide synthase, brain in Rat [ChEMBL: CHEMBL3048] [GtoPdb: 1251] [UniProtKB: P29476]
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  • Inducible NOS/Nitric oxide synthase, inducible in Mouse [ChEMBL: CHEMBL3464] [GtoPdb: 1250] [UniProtKB: P29477]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
NG,NG-Dimethylarginine dimethylaminohydrolase 1/N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6036] [GtoPdb: 1247] [UniProtKB: O94760]
ChEMBL Inhibition of human DDAH1 by plate-reader assay B 5.7 pKi 2000 nM Ki Bioorg Med Chem (2008) 16: 10205-10209 [PMID:19013076]
ChEMBL Inhibition of 6xHis-tagged recombinant human DDAH1 expressed in Escherichia coli BL21 cells using NMMA as substrate measured after 30 mins by colder reagent based microplate reader assay B 5.7 pKi 2000 nM Ki J Med Chem (2020) 63: 425-432 [PMID:31841335]
ChEMBL Inhibition of human DDAH1 expressed in Escherichia coli BL21 cells assessed as inhibition constant measured after 30 mins by calorimetric assay B 5.7 pKi 2000 nM Ki Bioorg Med Chem (2022) 72: 116970-116970 [PMID:36063653]
ChEMBL Inhibition of human DDAH1 expressed using SMTC as substrate assessed as inhibition constant measured after 5 mins B 5.7 pKi 2000 nM Ki Bioorg Med Chem (2022) 72: 116970-116970 [PMID:36063653]
GtoPdb - - 5.7 pKi 2000 nM Ki Bioorg Med Chem (2008) 16: 10205-9 [PMID:19013076]
ChEMBL Inhibition of human DDAH1 by plate-reader assay B 4.89 pIC50 13000 nM IC50 Bioorg Med Chem (2008) 16: 10205-10209 [PMID:19013076]
ChEMBL Inhibition of human DDAH1 expressed in Escherichia coli BL21 cells measured after 30 mins by calorimetric assay B 4.92 pIC50 12000 nM IC50 Bioorg Med Chem (2022) 72: 116970-116970 [PMID:36063653]
Neuronal NOS/Nitric-oxide synthase, brain in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3568] [GtoPdb: 1251] [UniProtKB: P29475]
ChEMBL Inhibition of nNOS assessed as conversion of L-[3H]arginine to L-[3H]citrulline B 7 pKi 100 nM Ki Bioorg Med Chem (2008) 16: 6193-6206 [PMID:18477512]
ChEMBL Inhibition of human nNOS assessed as inhibition constant measured after 5 mins B 7.05 pKi 90 nM Ki Bioorg Med Chem (2022) 72: 116970-116970 [PMID:36063653]
Neuronal NOS/Nitric-oxide synthase, brain in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3048] [GtoPdb: 1251] [UniProtKB: P29476]
ChEMBL Inhibition of rat nNOS transfected in HEK293 cells assessed as reduction of L-[14C]arginine to L-[14C]citrulline conversion by liquid scintillation counting analysis B 7 pKi 100 nM Ki Bioorg Med Chem (2022) 72: 116970-116970 [PMID:36063653]
Inducible NOS/Nitric oxide synthase, inducible in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3464] [GtoPdb: 1250] [UniProtKB: P29477]
ChEMBL Inhibition of mouse iNOS expressed in Escherichia coli assessed as reduction of L-[14C]arginine to L-[14C]citrulline conversion by liquid scintillation counting analysis B 4.22 pKi 60000 nM Ki Bioorg Med Chem (2022) 72: 116970-116970 [PMID:36063653]

ChEMBL data shown on this page come from version 34:

Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]