BDBM50148131 2-(4-Amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)-5-propylsulfanylmethyl-pyrrolidine-3,4-diol; 2hydrochloride::CHEMBL544806
SMILES: CCCSCC1NC(C(O)C1O)c1c[nH]c2c(N)ncnc12
InChI Key: InChIKey=SMSLFFRQRVMFGA-UHFFFAOYSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Methylthioadenosine Phosphorylase (MTAP) (Homo sapiens (Human)) | BDBM50148131 (2-(4-Amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)-5-prop...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid PDB UniChem Similars | PDB Article PubMed | 0.214 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Industrial Research Limited Curated by ChEMBL | Assay Description Equilibrium dissociation constant towards human 5'-methylthioadenosine phosphorylase | J Med Chem 47: 3275-81 (2004) Article DOI: 10.1021/jm0306475 BindingDB Entry DOI: 10.7270/Q2PZ59J8 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
Methylthioadenosine Phosphorylase (MTAP) (Homo sapiens (Human)) | BDBM50148131 (2-(4-Amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)-5-prop...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid PDB UniChem Similars | PDB Article PubMed | 4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Industrial Research Limited Curated by ChEMBL | Assay Description Initial dissociation constant towards human 5'-methylthioadenosine phosphorylase | J Med Chem 47: 3275-81 (2004) Article DOI: 10.1021/jm0306475 BindingDB Entry DOI: 10.7270/Q2PZ59J8 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |