BDBM121253 US8722896, (-)-(2R)-2-Methyl-3-(indol-7- ylmethylamino)-N-(3,4-dihydro- 2H-1,5-dioxepino-[2,3-b]pyridin- 8-ylmethyl)-N- isobutylpropanamide

SMILES: CC(C)CN(Cc1cnc2OCCCOc2c1)C(=O)C(C)CNCc1cccc2cc[nH]c12

InChI Key: InChIKey=KYEYCFUQJSHWMW-UHFFFAOYSA-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 = 121253   

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
Prokineticin receptor 2 (PRK2) (Cricetulus griseus (Chinese hamster))	BDBM121253 (US8722896, (-)-(2R)-2-Methyl-3-(indol-7- ylmethyla...) Show SMILES CC(C)CN(Cc1cnc2OCCCOc2c1)C(=O)C(C)CNCc1cccc2cc[nH]c12 Show InChI InChI=1S/C26H34N4O3/c1-18(2)16-30(17-20-12-23-25(29-14-20)33-11-5-10-32-23)26(31)19(3)13-27-15-22-7-4-6-21-8-9-28-24(21)22/h4,6-9,12,14,18-19,27-28H,5,10-11,13,15-17H2,1-3H3	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.39	-12.6	n/a	n/a	n/a	n/a	n/a	n/a	37
The Regents of the University of California US Patent					Assay Description An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...				US Patent US8722896 (2014) BindingDB Entry DOI: 10.7270/Q29G5KGF
					More data for this Ligand-Target Pair
Prokineticin receptor 1 (PRK1) (Cricetulus griseus (Chinese hamster))	BDBM121253 (US8722896, (-)-(2R)-2-Methyl-3-(indol-7- ylmethyla...) Show SMILES CC(C)CN(Cc1cnc2OCCCOc2c1)C(=O)C(C)CNCc1cccc2cc[nH]c12 Show InChI InChI=1S/C26H34N4O3/c1-18(2)16-30(17-20-12-23-25(29-14-20)33-11-5-10-32-23)26(31)19(3)13-27-15-22-7-4-6-21-8-9-28-24(21)22/h4,6-9,12,14,18-19,27-28H,5,10-11,13,15-17H2,1-3H3	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	6.68	-11.6	n/a	n/a	n/a	n/a	n/a	n/a	37
The Regents of the University of California US Patent					Assay Description An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...				US Patent US8722896 (2014) BindingDB Entry DOI: 10.7270/Q29G5KGF
					More data for this Ligand-Target Pair