BDBM64819 MLS-0359029.0001::N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-4-(2-methyl-1-piperidinyl)-6-thieno[2,3-d]pyrimidinecarboxamide::N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-4-(2-methylpiperidin-1-yl)thieno[2,3-d]pyrimidine-6-carboxamide::N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-4-(2-methylpiperidino)thieno[2,3-d]pyrimidine-6-carboxamide::cid_4120034
SMILES: CC1CCCCN1c1ncnc2sc(C(=O)Nc3ccc4OCCOc4c3)c(C)c12
InChI Key: InChIKey=JEYVGUXFRCDZFY-UHFFFAOYSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
nucleotide-binding oligomerization domain containing 1 (Homo sapiens (Human)) | BDBM64819 (MLS-0359029.0001 | N-(2,3-dihydro-1,4-benzodioxin-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | >3.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Lib... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2F47MKR | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
G-protein coupled receptor 55 (Homo sapiens (Human)) | BDBM64819 (MLS-0359029.0001 | N-(2,3-dihydro-1,4-benzodioxin-...) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 4.95E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Burnham Center for Chemical Genomics Curated by PubChem BioAssay | Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics(SSBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, C... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2028PZ5 | |||||||||||
More data for this Ligand-Target Pair |