BDBM260213 US9522914, A-15

SMILES: COc1cc(ccc1F)-c1nc(cn1CC(=O)NC(C)C)-c1ccc(CCN2C3CCC2CC(O)C3)cc1

InChI Key: InChIKey=PRGLVTYMUBVODA-UHFFFAOYSA-N

Data: 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 2 hits for monomerid = 260213   

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 V1b receptor (Homo sapiens (Human))	BDBM260213 (US9522914, A-15) Show SMILES COc1cc(ccc1F)-c1nc(cn1CC(=O)NC(C)C)-c1ccc(CCN2C3CCC2CC(O)C3)cc1 |THB:34:33:27:29.30| Show InChI InChI=1S/C30H37FN4O3/c1-19(2)32-29(37)18-34-17-27(33-30(34)22-8-11-26(31)28(14-22)38-3)21-6-4-20(5-7-21)12-13-35-23-9-10-24(35)16-25(36)15-23/h4-8,11,14,17,19,23-25,36H,9-10,12-13,15-16,18H2,1-3H3,(H,32,37)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.40	n/a	n/a	n/a	n/a	7.4	25
TAISHO PHARMACEUTICAL CO., LTD US Patent					Assay Description Human V1b receptor was transiently expressed in 293FT cells (Invitrogen). The cells were collected and then homogenated in a 15 mmol/L tris-hydrochlo...				US Patent US9522914 (2016) BindingDB Entry DOI: 10.7270/Q2KS6PR7
					More data for this Ligand-Target Pair
Vasopressin V1b receptor (Homo sapiens (Human))	BDBM260213 (US9522914, A-15) Show SMILES COc1cc(ccc1F)-c1nc(cn1CC(=O)NC(C)C)-c1ccc(CCN2C3CCC2CC(O)C3)cc1 |THB:34:33:27:29.30| Show InChI InChI=1S/C30H37FN4O3/c1-19(2)32-29(37)18-34-17-27(33-30(34)22-8-11-26(31)28(14-22)38-3)21-6-4-20(5-7-21)12-13-35-23-9-10-24(35)16-25(36)15-23/h4-8,11,14,17,19,23-25,36H,9-10,12-13,15-16,18H2,1-3H3,(H,32,37)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.40	n/a	n/a	n/a	n/a	7.4	4
TAISHO PHARMACEUTICAL CO., LTD US Patent					Assay Description Human V1b receptor was transiently expressed in 293FT cells (Invitrogen). The cells were collected and then homogenated in a 15 mmol/L tris-hydrochlo...				US Patent US9522914 (2016) BindingDB Entry DOI: 10.7270/Q2WM1CB9
					More data for this Ligand-Target Pair