null

SMILES: Brc1ccc-2c(CCCc3nnc([C@H]4CC[C@@H](CC4)Oc4ccccn4)n-23)c1

InChI Key:

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50546437   

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
Vasopressin V1a receptor (Homo sapiens (Human))	BDBM50546437 (CHEMBL4799412) Show SMILES Brc1ccc-2c(CCCc3nnc([C@H]4CC[C@@H](CC4)Oc4ccccn4)n-23)c1 |r,wU:13.12,wD:16.19,(39.85,-28.42,;41.2,-29.15,;42.52,-28.33,;43.87,-29.07,;43.91,-30.61,;42.6,-31.41,;42.41,-32.94,;43.49,-34.04,;45.02,-33.88,;45.85,-32.58,;47.38,-32.59,;47.85,-31.13,;46.61,-30.22,;46.6,-28.68,;45.27,-27.9,;45.28,-26.36,;46.62,-25.59,;47.95,-26.37,;47.95,-27.92,;46.63,-24.06,;45.3,-23.28,;45.32,-21.75,;43.99,-20.97,;42.66,-21.74,;42.66,-23.28,;43.98,-24.05,;45.36,-31.13,;41.25,-30.68,)| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		0.600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Vasopressin V1a receptor (Homo sapiens (Human))	BDBM50546437 (CHEMBL4799412) Show SMILES Brc1ccc-2c(CCCc3nnc([C@H]4CC[C@@H](CC4)Oc4ccccn4)n-23)c1 |r,wU:13.12,wD:16.19,(39.85,-28.42,;41.2,-29.15,;42.52,-28.33,;43.87,-29.07,;43.91,-30.61,;42.6,-31.41,;42.41,-32.94,;43.49,-34.04,;45.02,-33.88,;45.85,-32.58,;47.38,-32.59,;47.85,-31.13,;46.61,-30.22,;46.6,-28.68,;45.27,-27.9,;45.28,-26.36,;46.62,-25.59,;47.95,-26.37,;47.95,-27.92,;46.63,-24.06,;45.3,-23.28,;45.32,-21.75,;43.99,-20.97,;42.66,-21.74,;42.66,-23.28,;43.98,-24.05,;45.36,-31.13,;41.25,-30.68,)| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair