BDBM50095449 2-[1-(2-Amino-ethyl)-6-(3-amino-propylamino)-hexylsulfanylmethyl]-5-(6-amino-purin-9-yl)-tetrahydro-furan-3,4-diol::CHEMBL315995
SMILES: NCCCNCCCCCC(CCN)SC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
InChI Key: InChIKey=IYEWZPHRHXRMCW-BWZSZYTASA-N
Data: 5 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Spermidine synthase (Rattus norvegicus) | BDBM50095449 (2-[1-(2-Amino-ethyl)-6-(3-amino-propylamino)-hexyl...) | PDB MMDB Reactome pathway KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan Curated by ChEMBL | Assay Description Inhibition of Putrescine aminopropyltransferase (PAPT) in rat liver. | J Med Chem 38: 2714-27 (1995) BindingDB Entry DOI: 10.7270/Q23T9HW3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Spermidine synthase (Rattus norvegicus) | BDBM50095449 (2-[1-(2-Amino-ethyl)-6-(3-amino-propylamino)-hexyl...) | PDB MMDB Reactome pathway KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan Curated by ChEMBL | Assay Description Inhibition of Spermidine aminopropyltransferase (SAPT) in rat liver. | J Med Chem 38: 2714-27 (1995) BindingDB Entry DOI: 10.7270/Q23T9HW3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Spermidine synthase (Rattus norvegicus) | BDBM50095449 (2-[1-(2-Amino-ethyl)-6-(3-amino-propylamino)-hexyl...) | PDB MMDB Reactome pathway KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | >1.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Rensselaer Polytechnic Institute Curated by ChEMBL | Assay Description Inhibition of spermidine synthase activity was evaluated | J Med Chem 32: 1300-7 (1989) BindingDB Entry DOI: 10.7270/Q2VH5Q1K | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Spermidine synthase (Homo sapiens (Human)) | BDBM50095449 (2-[1-(2-Amino-ethyl)-6-(3-amino-propylamino)-hexyl...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Rensselaer Polytechnic Institute Curated by ChEMBL | Assay Description Inhibition of spermine synthase activity in rat ventral prostrate was evaluated at 100 uM | J Med Chem 32: 1300-7 (1989) BindingDB Entry DOI: 10.7270/Q2VH5Q1K | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Spermine synthase (Homo sapiens (Human)) | BDBM50095449 (2-[1-(2-Amino-ethyl)-6-(3-amino-propylamino)-hexyl...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Wayne State University Curated by ChEMBL | Assay Description Inhibitory activity against spermine synthase | J Med Chem 44: 1-26 (2001) BindingDB Entry DOI: 10.7270/Q28S4QNR | |||||||||||
More data for this Ligand-Target Pair |