BDBM288693 US10092551, Example 1::US10092551, Example 26

SMILES: C\C(=C1\SC(=NC1=O)N1CCC2(CC1)OCc1ccccc21)c1ccc(Cl)cc1

InChI Key: InChIKey=ZDRHWGCUJHNNAJ-HKWRFOASSA-N

Data: 2 KI

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 = 288693   

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))	BDBM288693 (US10092551, Example 1 | US10092551, Example 26) Show SMILES C\C(=C1\SC(=NC1=O)N1CCC2(CC1)OCc1ccccc21)c1ccc(Cl)cc1 |c:4| Show InChI InChI=1S/C23H21ClN2O2S/c1-15(16-6-8-18(24)9-7-16)20-21(27)25-22(29-20)26-12-10-23(11-13-26)19-5-3-2-4-17(19)14-28-23/h2-9H,10-14H2,1H3/b20-15-	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.631	-12.5	n/a	n/a	n/a	n/a	n/a	n/a	25
Hoffmann-LaRoche Inc. US Patent					Assay Description The human V1a receptor was cloned by RT-PCR from total human liver RNA. The coding sequence was subcloned in an expression vector after sequencing to...				US Patent US10092551 (2018) BindingDB Entry DOI: 10.7270/Q2348NFN
					More data for this Ligand-Target Pair
Vasopressin V1a receptor (Homo sapiens (Human))	BDBM288693 (US10092551, Example 1 | US10092551, Example 26) Show SMILES C\C(=C1\SC(=NC1=O)N1CCC2(CC1)OCc1ccccc21)c1ccc(Cl)cc1 |c:4| Show InChI InChI=1S/C23H21ClN2O2S/c1-15(16-6-8-18(24)9-7-16)20-21(27)25-22(29-20)26-12-10-23(11-13-26)19-5-3-2-4-17(19)14-28-23/h2-9H,10-14H2,1H3/b20-15-	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.26	-12.1	n/a	n/a	n/a	n/a	n/a	n/a	25
Hoffmann-LaRoche Inc. US Patent					Assay Description The human V1a receptor was cloned by RT-PCR from total human liver RNA. The coding sequence was subcloned in an expression vector after sequencing to...				US Patent US10092551 (2018) BindingDB Entry DOI: 10.7270/Q2348NFN
					More data for this Ligand-Target Pair