BDBM288715 US10092551, Example 23

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

InChI Key: InChIKey=IELLNYZUPXJLDA-ZZEZOPTASA-N

Data: 1 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 1 hit for monomerid = 288715   

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))	BDBM288715 (US10092551, Example 23) Show SMILES FC\C(=C1\SC(=NC1=O)N1CCC2(CC1)OCc1ccccc21)c1ccc(Cl)cc1 |c:5| Show InChI InChI=1S/C23H20ClFN2O2S/c24-17-7-5-15(6-8-17)18(13-25)20-21(28)26-22(30-20)27-11-9-23(10-12-27)19-4-2-1-3-16(19)14-29-23/h1-8H,9-14H2/b20-18-	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.398	-12.8	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