Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1/2' and Ligand = 'BDBM50515047'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cannabinoid receptor 1/2 (Rattus norvegicus (Rat)-Rattus norvegicus (rat))	BDBM50515047 (CHEMBL4526969) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)CC\C2=N\OCC(=O)NCCNC(=O)CCCCCn1cc(C(=O)c2cccc4ccccc24)c2ccccc12)ccc3OC |r,THB:10:9:14:4.5.6| Show InChI InChI=1S/C47H51N5O7/c1-51-26-22-46-42-31-18-19-38(57-2)44(42)59-45(46)36(20-21-47(46,56)39(51)27-31)50-58-29-41(54)49-24-23-48-40(53)17-4-3-9-25-52-28-35(33-14-7-8-16-37(33)52)43(55)34-15-10-12-30-11-5-6-13-32(30)34/h5-8,10-16,18-19,28,39,45,56H,3-4,9,17,20-27,29H2,1-2H3,(H,48,53)(H,49,54)/b50-36-/t39-,45+,46+,47-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	9.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biological Research Centre of the Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]WIN-55,212-2 from CB1R/CB2R in Wistar rat brain membranes after 60 mins by liquid scintillation analysis				Eur J Med Chem 178: 571-588 (2019) Article DOI: 10.1016/j.ejmech.2019.05.037 BindingDB Entry DOI: 10.7270/Q2Z60SD8
					More data for this Ligand-Target Pair
Cannabinoid receptor 1/2 (Rattus norvegicus (Rat)-Rattus norvegicus (rat))	BDBM50515047 (CHEMBL4526969) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)CC\C2=N\OCC(=O)NCCNC(=O)CCCCCn1cc(C(=O)c2cccc4ccccc24)c2ccccc12)ccc3OC |r,THB:10:9:14:4.5.6| Show InChI InChI=1S/C47H51N5O7/c1-51-26-22-46-42-31-18-19-38(57-2)44(42)59-45(46)36(20-21-47(46,56)39(51)27-31)50-58-29-41(54)49-24-23-48-40(53)17-4-3-9-25-52-28-35(33-14-7-8-16-37(33)52)43(55)34-15-10-12-30-11-5-6-13-32(30)34/h5-8,10-16,18-19,28,39,45,56H,3-4,9,17,20-27,29H2,1-2H3,(H,48,53)(H,49,54)/b50-36-/t39-,45+,46+,47-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	255	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biological Research Centre of the Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]JWH-018 from CB1R/CB2R in Wistar rat brain membranes after 60 mins by liquid scintillation analysis				Eur J Med Chem 178: 571-588 (2019) Article DOI: 10.1016/j.ejmech.2019.05.037 BindingDB Entry DOI: 10.7270/Q2Z60SD8
					More data for this Ligand-Target Pair