BDBM100779 US8507535, 18

SMILES: CC(=O)c1ccc(nc1)N1CCC(CC1)C(=O)N1C[C@H](c2ccc(Cl)cc2)[C@@](C)(COc2ccc(Cl)cn2)C1

InChI Key: InChIKey=RWMMALLVDRWQGJ-PDDLMNHVSA-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 = 100779   

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
Neuromedin-K receptor (Homo sapiens (Human))	BDBM100779 (US8507535, 18) Show SMILES CC(=O)c1ccc(nc1)N1CCC(CC1)C(=O)N1C[C@H](c2ccc(Cl)cc2)[C@@](C)(COc2ccc(Cl)cn2)C1 |r| Show InChI InChI=1S/C30H32Cl2N4O3/c1-20(37)23-5-9-27(33-15-23)35-13-11-22(12-14-35)29(38)36-17-26(21-3-6-24(31)7-4-21)30(2,18-36)19-39-28-10-8-25(32)16-34-28/h3-10,15-16,22,26H,11-14,17-19H2,1-2H3/t26-,30-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	5.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Competition binding assay using hNK3 receptor.				US Patent US8507535 (2013) BindingDB Entry DOI: 10.7270/Q27H1H67
					More data for this Ligand-Target Pair