BDBM50292278 CHEMBL4174271

SMILES: CCN1CCN(CC1)c1nc(C)nc2oc(nc12)-c1ccccc1Cl

InChI Key: InChIKey=XWYLNWVTWBTYTQ-UHFFFAOYSA-N

Data: 2 KI  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 4 hits for monomerid = 50292278   

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))	BDBM50292278 (CHEMBL4174271) Show SMILES CCN1CCN(CC1)c1nc(C)nc2oc(nc12)-c1ccccc1Cl Show InChI InChI=1S/C18H20ClN5O/c1-3-23-8-10-24(11-9-23)16-15-18(21-12(2)20-16)25-17(22-15)13-6-4-5-7-14(13)19/h4-7H,3,8-11H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Univ. Lille Curated by ChEMBL					Assay Description Displacement of [3H]-CP-55940 from human CB2 expressed in CHO cells after 90 mins by TopCount scintillation counting method				Eur J Med Chem 146: 68-78 (2018) Article DOI: 10.1016/j.ejmech.2018.01.034 BindingDB Entry DOI: 10.7270/Q2N58PXN
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50292278 (CHEMBL4174271) Show SMILES CCN1CCN(CC1)c1nc(C)nc2oc(nc12)-c1ccccc1Cl Show InChI InChI=1S/C18H20ClN5O/c1-3-23-8-10-24(11-9-23)16-15-18(21-12(2)20-16)25-17(22-15)13-6-4-5-7-14(13)19/h4-7H,3,8-11H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	293	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Univ. Lille Curated by ChEMBL					Assay Description Inhibition of rate of ADP-stimulated gel-filtered human platelet aggregation mediated by integrin alphaIIb beta-3 in PLAGGIN assay				Eur J Med Chem 146: 68-78 (2018) Article DOI: 10.1016/j.ejmech.2018.01.034 BindingDB Entry DOI: 10.7270/Q2N58PXN
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50292278 (CHEMBL4174271) Show SMILES CCN1CCN(CC1)c1nc(C)nc2oc(nc12)-c1ccccc1Cl Show InChI InChI=1S/C18H20ClN5O/c1-3-23-8-10-24(11-9-23)16-15-18(21-12(2)20-16)25-17(22-15)13-6-4-5-7-14(13)19/h4-7H,3,8-11H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Univ. Lille Curated by ChEMBL					Assay Description Inhibition of very late antigen-4 alpha4-beta1 (VLA-4), I-VCAM-Ig as radioligand				Eur J Med Chem 146: 68-78 (2018) Article DOI: 10.1016/j.ejmech.2018.01.034 BindingDB Entry DOI: 10.7270/Q2N58PXN
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50292278 (CHEMBL4174271) Show SMILES CCN1CCN(CC1)c1nc(C)nc2oc(nc12)-c1ccccc1Cl Show InChI InChI=1S/C18H20ClN5O/c1-3-23-8-10-24(11-9-23)16-15-18(21-12(2)20-16)25-17(22-15)13-6-4-5-7-14(13)19/h4-7H,3,8-11H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Univ. Lille Curated by ChEMBL					Assay Description Neutral antagonist activity at human CB2 assessed as restoration of forskolin-induced cAMP formation preincubated for 15 mins followed by forskolin a...				Eur J Med Chem 146: 68-78 (2018) Article DOI: 10.1016/j.ejmech.2018.01.034 BindingDB Entry DOI: 10.7270/Q2N58PXN
					More data for this Ligand-Target Pair