BDBM84121 5-[(4-bromophenyl)methyl]-7-(phenylmethyl)-4-(4-phenyl-1-piperazinyl)-7,8-dihydropteridin-6-one::5-[(4-bromophenyl)methyl]-7-(phenylmethyl)-4-(4-phenylpiperazin-1-yl)-7,8-dihydropteridin-6-one::7-benzyl-5-(4-bromobenzyl)-4-(4-phenylpiperazino)-7,8-dihydropteridin-6-one::7-benzyl-5-[(4-bromophenyl)methyl]-4-(4-phenylpiperazin-1-yl)-7,8-dihydropteridin-6-one::MLS001074624::SMR000814268::cid_42600948
SMILES: Brc1ccc(CN2C(=O)C(Cc3ccccc3)Nc3ncnc(N4CCN(CC4)c4ccccc4)c23)cc1
InChI Key: InChIKey=SJVJGNJQMCDUGK-UHFFFAOYSA-N
Data: 3 EC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
drug resistance protein 2 (Candida albicans) | BDBM84121 (5-[(4-bromophenyl)methyl]-7-(phenylmethyl)-4-(4-ph...) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 1.08E+4 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description UNMCMD Assay Overview: Assay Support: 1 R03 MH087406-01A1 Project Title: Identification of broad-spectrum antifungal efflux pump inhibitors ... | PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q28C9TSJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Candida albicans strain ATCC 10261 multidrug efflux pump (MDR1) gene, MDR1-A allele, complete cds (Candida albicans) | BDBM84121 (5-[(4-bromophenyl)methyl]-7-(phenylmethyl)-4-(4-ph...) | UniProtKB/TrEMBL GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 2.12E+4 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description UNMCMD Assay Overview: Assay Support: 1 R03 MH087406-01A1 Project Title: Identification of broad-spectrum antifungal efflux pump inhibitors ... | PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q20V8B9F | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
drug resistance protein 1 (Candida albicans) | BDBM84121 (5-[(4-bromophenyl)methyl]-7-(phenylmethyl)-4-(4-ph...) | UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 1.11E+4 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description UNMCMD Assay Overview: Assay Support: 1 R03 MH087406-01A1 Project Title: Identification of broad-spectrum antifungal efflux pump inhibitors ... | PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q24M932M | |||||||||||
More data for this Ligand-Target Pair |