BDBM260253 US9522914, B-06

SMILES: COc1cc(ccc1F)-c1nc(nn1CC(=O)NC(C)C)-c1ccc(CCN2C3CCC2COC3)cn1

InChI Key: InChIKey=ZVWPUDSCBKVVLT-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 = 260253   

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))	BDBM260253 (US9522914, B-06) Show SMILES COc1cc(ccc1F)-c1nc(nn1CC(=O)NC(C)C)-c1ccc(CCN2C3CCC2COC3)cn1 Show InChI InChI=1S/C27H33FN6O3/c1-17(2)30-25(35)14-34-27(19-5-8-22(28)24(12-19)36-3)31-26(32-34)23-9-4-18(13-29-23)10-11-33-20-6-7-21(33)16-37-15-20/h4-5,8-9,12-13,17,20-21H,6-7,10-11,14-16H2,1-3H3,(H,30,35)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.30	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))	BDBM260253 (US9522914, B-06) Show SMILES COc1cc(ccc1F)-c1nc(nn1CC(=O)NC(C)C)-c1ccc(CCN2C3CCC2COC3)cn1 Show InChI InChI=1S/C27H33FN6O3/c1-17(2)30-25(35)14-34-27(19-5-8-22(28)24(12-19)36-3)31-26(32-34)23-9-4-18(13-29-23)10-11-33-20-6-7-21(33)16-37-15-20/h4-5,8-9,12-13,17,20-21H,6-7,10-11,14-16H2,1-3H3,(H,30,35)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.30	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