BDBM50029968 CHEMBL3353425

SMILES: CC1CCC(CC1)NC(=O)c1cc2cccnc2n(CCO)c1=O

InChI Key: InChIKey=RWSHWYIQVOMVLL-UHFFFAOYSA-N

Data: 2 KI

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 = 50029968   

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))	BDBM50029968 (CHEMBL3353425) Show SMILES CC1CCC(CC1)NC(=O)c1cc2cccnc2n(CCO)c1=O |(40.53,3.04,;39.2,2.26,;39.2,.72,;37.88,-.05,;36.54,.72,;36.53,2.25,;37.87,3.03,;35.22,-.06,;33.88,.71,;33.87,2.25,;32.56,-.07,;31.22,.7,;29.9,-.09,;28.57,.69,;27.24,-.09,;27.24,-1.63,;28.57,-2.4,;29.9,-1.63,;31.23,-2.39,;31.24,-3.93,;29.91,-4.7,;29.91,-6.24,;32.56,-1.62,;33.9,-2.38,)| Show InChI InChI=1S/C18H23N3O3/c1-12-4-6-14(7-5-12)20-17(23)15-11-13-3-2-8-19-16(13)21(9-10-22)18(15)24/h2-3,8,11-12,14,22H,4-7,9-10H2,1H3,(H,20,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description HEK293DHEK293iHEK293sHEK293pHEK293lHEK293aHEK293cHEK293eHEK293mHEK293eHEK293nHEK293tHEK293 HEK293oHEK293fHEK293 HEK293[HEK2933HEK293HHEK293]HEK293CHE...				J Med Chem 57: 8777-91 (2014) Article DOI: 10.1021/jm500807e BindingDB Entry DOI: 10.7270/Q2QC054S
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50029968 (CHEMBL3353425) Show SMILES CC1CCC(CC1)NC(=O)c1cc2cccnc2n(CCO)c1=O |(40.53,3.04,;39.2,2.26,;39.2,.72,;37.88,-.05,;36.54,.72,;36.53,2.25,;37.87,3.03,;35.22,-.06,;33.88,.71,;33.87,2.25,;32.56,-.07,;31.22,.7,;29.9,-.09,;28.57,.69,;27.24,-.09,;27.24,-1.63,;28.57,-2.4,;29.9,-1.63,;31.23,-2.39,;31.24,-3.93,;29.91,-4.7,;29.91,-6.24,;32.56,-1.62,;33.9,-2.38,)| Show InChI InChI=1S/C18H23N3O3/c1-12-4-6-14(7-5-12)20-17(23)15-11-13-3-2-8-19-16(13)21(9-10-22)18(15)24/h2-3,8,11-12,14,22H,4-7,9-10H2,1H3,(H,20,23)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description HEK293DHEK293iHEK293sHEK293pHEK293lHEK293aHEK293cHEK293eHEK293mHEK293eHEK293nHEK293tHEK293 HEK293oHEK293fHEK293 HEK293[HEK2933HEK293HHEK293]HEK293CHE...				J Med Chem 57: 8777-91 (2014) Article DOI: 10.1021/jm500807e BindingDB Entry DOI: 10.7270/Q2QC054S
					More data for this Ligand-Target Pair