BDBM135977 US8853203, 31::US8853203, 32::US9650377, Example 47

SMILES: Cn1ccc(n1)C1=NCC(=O)N2CCc3c(I)cccc3C2=C1

InChI Key: InChIKey=QXXCGFFXNAYIRR-UHFFFAOYSA-N

Data: 8 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 8 hits for monomerid = 135977   

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))	BDBM135977 (US8853203, 31 | US8853203, 32 | US9650377, Example...) Show SMILES Cn1ccc(n1)C1=NCC(=O)N2CCc3c(I)cccc3C2=C1 |c:24,t:7| Show InChI InChI=1S/C17H15IN4O/c1-21-7-6-14(20-21)15-9-16-12-3-2-4-13(18)11(12)5-8-22(16)17(23)10-19-15/h2-4,6-7,9H,5,8,10H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	167	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Activity of compounds of the present invention was examined by determination to what extent the glutamate-induced elevation of the intracellular calc...				US Patent US8853203 (2014) BindingDB Entry DOI: 10.7270/Q2MP520T
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM135977 (US8853203, 31 | US8853203, 32 | US9650377, Example...) Show SMILES Cn1ccc(n1)C1=NCC(=O)N2CCc3c(I)cccc3C2=C1 |c:24,t:7| Show InChI InChI=1S/C17H15IN4O/c1-21-7-6-14(20-21)15-9-16-12-3-2-4-13(18)11(12)5-8-22(16)17(23)10-19-15/h2-4,6-7,9H,5,8,10H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Activity of compounds of the present invention was examined by determination to what extent the glutamate-induced elevation of the intracellular calc...				US Patent US8853203 (2014) BindingDB Entry DOI: 10.7270/Q2MP520T
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 1 (Homo sapiens (Human))	BDBM135977 (US8853203, 31 | US8853203, 32 | US9650377, Example...) Show SMILES Cn1ccc(n1)C1=NCC(=O)N2CCc3c(I)cccc3C2=C1 |c:24,t:7| Show InChI InChI=1S/C17H15IN4O/c1-21-7-6-14(20-21)15-9-16-12-3-2-4-13(18)11(12)5-8-22(16)17(23)10-19-15/h2-4,6-7,9H,5,8,10H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Activity of compounds of the present invention was examined by determination to what extent the glutamate-induced elevation of the intracellular calc...				US Patent US8853203 (2014) BindingDB Entry DOI: 10.7270/Q2MP520T
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 1 (Homo sapiens (Human))	BDBM135977 (US8853203, 31 | US8853203, 32 | US9650377, Example...) Show SMILES Cn1ccc(n1)C1=NCC(=O)N2CCc3c(I)cccc3C2=C1 |c:24,t:7| Show InChI InChI=1S/C17H15IN4O/c1-21-7-6-14(20-21)15-9-16-12-3-2-4-13(18)11(12)5-8-22(16)17(23)10-19-15/h2-4,6-7,9H,5,8,10H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Activity of compounds of the present invention was examined by determination to what extent the glutamate-induced elevation of the intracellular calc...				US Patent US9650377 (2017) BindingDB Entry DOI: 10.7270/Q2G73GT2
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM135977 (US8853203, 31 | US8853203, 32 | US9650377, Example...) Show SMILES Cn1ccc(n1)C1=NCC(=O)N2CCc3c(I)cccc3C2=C1 |c:24,t:7| Show InChI InChI=1S/C17H15IN4O/c1-21-7-6-14(20-21)15-9-16-12-3-2-4-13(18)11(12)5-8-22(16)17(23)10-19-15/h2-4,6-7,9H,5,8,10H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	167	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Activity of compounds of the present invention with respect to mGluR1 antagonism was examined by an assay based on measurements of L-glutamate induce...				US Patent US9650377 (2017) BindingDB Entry DOI: 10.7270/Q2G73GT2
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 1 (Homo sapiens (Human))	BDBM135977 (US8853203, 31 | US8853203, 32 | US9650377, Example...) Show SMILES Cn1ccc(n1)C1=NCC(=O)N2CCc3c(I)cccc3C2=C1 |c:24,t:7| Show InChI InChI=1S/C17H15IN4O/c1-21-7-6-14(20-21)15-9-16-12-3-2-4-13(18)11(12)5-8-22(16)17(23)10-19-15/h2-4,6-7,9H,5,8,10H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Activity of compounds of the present invention was examined by determination to what extent the glutamate-induced elevation of the intracellular calc...				US Patent US9650377 (2017) BindingDB Entry DOI: 10.7270/Q2G73GT2
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 5 (Homo sapiens (Human))	BDBM135977 (US8853203, 31 | US8853203, 32 | US9650377, Example...) Show SMILES Cn1ccc(n1)C1=NCC(=O)N2CCc3c(I)cccc3C2=C1 |c:24,t:7| Show InChI InChI=1S/C17H15IN4O/c1-21-7-6-14(20-21)15-9-16-12-3-2-4-13(18)11(12)5-8-22(16)17(23)10-19-15/h2-4,6-7,9H,5,8,10H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	71	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Activity of compounds of the present invention with respect to mGluR1 antagonism was examined by an assay based on measurements of L-glutamate induce...				US Patent US9650377 (2017) BindingDB Entry DOI: 10.7270/Q2G73GT2
					More data for this Ligand-Target Pair
Metabotropic glutamate receptor 1 (Homo sapiens (Human))	BDBM135977 (US8853203, 31 | US8853203, 32 | US9650377, Example...) Show SMILES Cn1ccc(n1)C1=NCC(=O)N2CCc3c(I)cccc3C2=C1 |c:24,t:7| Show InChI InChI=1S/C17H15IN4O/c1-21-7-6-14(20-21)15-9-16-12-3-2-4-13(18)11(12)5-8-22(16)17(23)10-19-15/h2-4,6-7,9H,5,8,10H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Activity of compounds of the present invention was examined by determination to what extent the glutamate-induced elevation of the intracellular calc...				US Patent US8853203 (2014) BindingDB Entry DOI: 10.7270/Q2MP520T
					More data for this Ligand-Target Pair