BDBM74255 (3-amino-2-methyl-phenyl)amine::1,3-Benzenediamine, 2-methyl-::2-methylbenzene-1,3-diamine::MLS002174248::SMR001261423::cid_13205
SMILES: Cc1c(N)cccc1N
InChI Key: InChIKey=RLYCRLGLCUXUPO-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 |
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Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human)) | BDBM74255 ((3-amino-2-methyl-phenyl)amine | 1,3-Benzenediamin...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid PDB UniChem | PDB Article PubMed | n/a | n/a | 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Johns Hopkins University School of Medicine Curated by ChEMBL | Assay Description Inhibition of full length PI3Kalpha (unknown origin) assessed as reduction in PIP3 formation using PIP2 as substrate after 45 mins by fluorescence po... | Bioorg Med Chem 25: 1481-1486 (2017) Article DOI: 10.1016/j.bmc.2017.01.012 BindingDB Entry DOI: 10.7270/Q2028TQP | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
LANA (Human herpesvirus 8) | BDBM74255 ((3-amino-2-methyl-phenyl)amine | 1,3-Benzenediamin...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase PC cid PC sid PDB UniChem | PCBioAssay | n/a | n/a | n/a | n/a | >7.50E+4 | n/a | n/a | n/a | n/a |
Broad Institute Curated by PubChem BioAssay | Assay Description Primary Collaborators: Kenneth Kaye,Brigham & Womens,Boston MA,kkaye@rics.bwh.harvard.edu,617-525-4256 Chantal Beauchemin,Brigham & Womens,Boston MA,... | PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2HH6HHN | |||||||||||
More data for this Ligand-Target Pair |