BDBM292181 US10100057, Example 36::US9745310, Example 36

SMILES: Clc1cnccc1-c1cnc2nc(COc3ccccc3)cn2c1

InChI Key: InChIKey=CBRWAMSWNHQWIT-UHFFFAOYSA-N

Data: 2 EC50

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 3 hits for monomerid = 292181   

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
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM292181 (US10100057, Example 36 | US11046702, Example 36 | ...) Show SMILES Clc1cnccc1-c1cnc2nc(COc3ccccc3)cn2c1 Show InChI InChI=1S/C18H13ClN4O/c19-17-9-20-7-6-16(17)13-8-21-18-22-14(11-23(18)10-13)12-24-15-4-2-1-3-5-15/h1-11H,12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	300	n/a	n/a	n/a	25
SK BIOPHARMACEUTICALS CO., LTD. US Patent					Assay Description Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...				US Patent US10100057 (2018) BindingDB Entry DOI: 10.7270/Q2028TKW
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM292181 (US10100057, Example 36 | US11046702, Example 36 | ...) Show SMILES Clc1cnccc1-c1cnc2nc(COc3ccccc3)cn2c1 Show InChI InChI=1S/C18H13ClN4O/c19-17-9-20-7-6-16(17)13-8-21-18-22-14(11-23(18)10-13)12-24-15-4-2-1-3-5-15/h1-11H,12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	300	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM292181 (US10100057, Example 36 | US11046702, Example 36 | ...) Show SMILES Clc1cnccc1-c1cnc2nc(COc3ccccc3)cn2c1 Show InChI InChI=1S/C18H13ClN4O/c19-17-9-20-7-6-16(17)13-8-21-18-22-14(11-23(18)10-13)12-24-15-4-2-1-3-5-15/h1-11H,12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	300	n/a	n/a	n/a	n/a
SK BIOPHARMACEUTICALS CO., LTD. US Patent					Assay Description Ca2+ (calcium) influx assay is an experiment for measuring the activity of a positive allosteric modulator of mGluR5 receptor in which human mGluR5 r...				US Patent US9745310 (2017) BindingDB Entry DOI: 10.7270/Q24T6MG4
					More data for this Ligand-Target Pair