BDBM83251 6-[2-(4-aminophenyl)ethynyl]-2,3-dimethoxy-9-xanthenone::6-[2-(4-aminophenyl)ethynyl]-2,3-dimethoxy-xanthen-9-one::6-[2-(4-aminophenyl)ethynyl]-2,3-dimethoxy-xanthone::6-[2-(4-aminophenyl)ethynyl]-2,3-dimethoxyxanthen-9-one::MLS001144048::SMR000526304::cid_24747933

SMILES: COc1cc2oc3cc(ccc3c(=O)c2cc1OC)C#Cc1ccc(N)cc1

InChI Key: InChIKey=CTDHVIJMNJECKF-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 83251   

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
Beta lactamase (Pseudomonas aeruginosa)	BDBM83251 (6-[2-(4-aminophenyl)ethynyl]-2,3-dimethoxy-9-xanth...) Show SMILES COc1cc2oc3cc(ccc3c(=O)c2cc1OC)C#Cc1ccc(N)cc1 Show InChI InChI=1S/C23H17NO4/c1-26-21-12-18-20(13-22(21)27-2)28-19-11-15(7-10-17(19)23(18)25)4-3-14-5-8-16(24)9-6-14/h5-13H,24H2,1-2H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2G15ZB8
					More data for this Ligand-Target Pair
Toll-like receptor 9 (Homo sapiens (Human))	BDBM83251 (6-[2-(4-aminophenyl)ethynyl]-2,3-dimethoxy-9-xanth...) Show SMILES COc1cc2oc3cc(ccc3c(=O)c2cc1OC)C#Cc1ccc(N)cc1 Show InChI InChI=1S/C23H17NO4/c1-26-21-12-18-20(13-22(21)27-2)28-19-11-15(7-10-17(19)23(18)25)4-3-14-5-8-16(24)9-6-14/h5-13H,24H2,1-2H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	6.41E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2KS6Q2P
					More data for this Ligand-Target Pair