BDBM50449599 CHEMBL4169536

SMILES: O=C1N2CCCSC2=N\C1=C/c1cccc(OCCCc2ccccc2)c1

InChI Key: InChIKey=PLSWADCBNSNPGS-SILNSSARSA-N

Data: 2 KI  2 IC50  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 6 hits for monomerid = 50449599   

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
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50449599 (CHEMBL4169536) Show SMILES O=C1N2CCCSC2=N\C1=C/c1cccc(OCCCc2ccccc2)c1 |c:8| Show InChI InChI=1S/C22H22N2O2S/c25-21-20(23-22-24(21)12-6-14-27-22)16-18-9-4-11-19(15-18)26-13-5-10-17-7-2-1-3-8-17/h1-4,7-9,11,15-16H,5-6,10,12-14H2/b20-16-	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from recombinant human CB2 receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting method				Eur J Med Chem 155: 381-397 (2018) Article DOI: 10.1016/j.ejmech.2018.05.050 BindingDB Entry DOI: 10.7270/Q22F7R1X
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50449599 (CHEMBL4169536) Show SMILES O=C1N2CCCSC2=N\C1=C/c1cccc(OCCCc2ccccc2)c1 |c:8| Show InChI InChI=1S/C22H22N2O2S/c25-21-20(23-22-24(21)12-6-14-27-22)16-18-9-4-11-19(15-18)26-13-5-10-17-7-2-1-3-8-17/h1-4,7-9,11,15-16H,5-6,10,12-14H2/b20-16-	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from recombinant human CB1 receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting method				Eur J Med Chem 155: 381-397 (2018) Article DOI: 10.1016/j.ejmech.2018.05.050 BindingDB Entry DOI: 10.7270/Q22F7R1X
					More data for this Ligand-Target Pair
N-arachidonyl glycine receptor (Homo sapiens (Human))	BDBM50449599 (CHEMBL4169536) Show SMILES O=C1N2CCCSC2=N\C1=C/c1cccc(OCCCc2ccccc2)c1 |c:8| Show InChI InChI=1S/C22H22N2O2S/c25-21-20(23-22-24(21)12-6-14-27-22)16-18-9-4-11-19(15-18)26-13-5-10-17-7-2-1-3-8-17/h1-4,7-9,11,15-16H,5-6,10,12-14H2/b20-16-	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Agonist activity at recombinant human GPR18 expressed in CHO cells assessed as increase in beta-arrestin recruitment incubated for 60 mins measured f...				Eur J Med Chem 155: 381-397 (2018) Article DOI: 10.1016/j.ejmech.2018.05.050 BindingDB Entry DOI: 10.7270/Q22F7R1X
					More data for this Ligand-Target Pair
N-arachidonyl glycine receptor (Homo sapiens (Human))	BDBM50449599 (CHEMBL4169536) Show SMILES O=C1N2CCCSC2=N\C1=C/c1cccc(OCCCc2ccccc2)c1 |c:8| Show InChI InChI=1S/C22H22N2O2S/c25-21-20(23-22-24(21)12-6-14-27-22)16-18-9-4-11-19(15-18)26-13-5-10-17-7-2-1-3-8-17/h1-4,7-9,11,15-16H,5-6,10,12-14H2/b20-16-	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.49E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Antagonist activity at recombinant human GPR18 expressed in CHO cells assessed as inhibition of delta9-THC-induced beta-arrestin recruitment preincub...				Eur J Med Chem 155: 381-397 (2018) Article DOI: 10.1016/j.ejmech.2018.05.050 BindingDB Entry DOI: 10.7270/Q22F7R1X
					More data for this Ligand-Target Pair
G-protein coupled receptor 55 (Homo sapiens (Human))	BDBM50449599 (CHEMBL4169536) Show SMILES O=C1N2CCCSC2=N\C1=C/c1cccc(OCCCc2ccccc2)c1 |c:8| Show InChI InChI=1S/C22H22N2O2S/c25-21-20(23-22-24(21)12-6-14-27-22)16-18-9-4-11-19(15-18)26-13-5-10-17-7-2-1-3-8-17/h1-4,7-9,11,15-16H,5-6,10,12-14H2/b20-16-	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Antagonist activity at recombinant human GPR55 expressed in CHO cells assessed as inhibition of lysophosphatidylinositol-induced beta-arrestin recrui...				Eur J Med Chem 155: 381-397 (2018) Article DOI: 10.1016/j.ejmech.2018.05.050 BindingDB Entry DOI: 10.7270/Q22F7R1X
					More data for this Ligand-Target Pair
G-protein coupled receptor 55 (Homo sapiens (Human))	BDBM50449599 (CHEMBL4169536) Show SMILES O=C1N2CCCSC2=N\C1=C/c1cccc(OCCCc2ccccc2)c1 |c:8| Show InChI InChI=1S/C22H22N2O2S/c25-21-20(23-22-24(21)12-6-14-27-22)16-18-9-4-11-19(15-18)26-13-5-10-17-7-2-1-3-8-17/h1-4,7-9,11,15-16H,5-6,10,12-14H2/b20-16-	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Agonist activity at recombinant human GPR55 expressed in CHO cells assessed as increase in beta-arrestin recruitment incubated for 60 mins measured f...				Eur J Med Chem 155: 381-397 (2018) Article DOI: 10.1016/j.ejmech.2018.05.050 BindingDB Entry DOI: 10.7270/Q22F7R1X
					More data for this Ligand-Target Pair