BDBM121274 US8722896, (+/-)-4-(Indol-7-ylmethyl)-N-(9- chloro-3,4-dihydro-2H-1,5- benzodioxepin-7-ylmethyl)-N- isobutylmorpholine-2- carboxamide

SMILES: CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)C1CN(Cc2cccc3cc[nH]c23)CCO1

InChI Key: InChIKey=MMDJGANIWNFLIU-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 121274   

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 1 (PRK1) (Cricetulus griseus (Chinese hamster))	BDBM121274 (US8722896, (+/-)-4-(Indol-7-ylmethyl)-N-(9- chloro...) Show SMILES CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)C1CN(Cc2cccc3cc[nH]c23)CCO1 Show InChI InChI=1S/C28H34ClN3O4/c1-19(2)15-32(16-20-13-23(29)27-24(14-20)34-10-4-11-36-27)28(33)25-18-31(9-12-35-25)17-22-6-3-5-21-7-8-30-26(21)22/h3,5-8,13-14,19,25,30H,4,9-12,15-18H2,1-2H3	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	1.13	-12.7	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 2 (PRK2) (Cricetulus griseus (Chinese hamster))	BDBM121274 (US8722896, (+/-)-4-(Indol-7-ylmethyl)-N-(9- chloro...) Show SMILES CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)C1CN(Cc2cccc3cc[nH]c23)CCO1 Show InChI InChI=1S/C28H34ClN3O4/c1-19(2)15-32(16-20-13-23(29)27-24(14-20)34-10-4-11-36-27)28(33)25-18-31(9-12-35-25)17-22-6-3-5-21-7-8-30-26(21)22/h3,5-8,13-14,19,25,30H,4,9-12,15-18H2,1-2H3	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	3.30	-12.0	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))	BDBM121274 (US8722896, (+/-)-4-(Indol-7-ylmethyl)-N-(9- chloro...) Show SMILES CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)C1CN(Cc2cccc3cc[nH]c23)CCO1 Show InChI InChI=1S/C28H34ClN3O4/c1-19(2)15-32(16-20-13-23(29)27-24(14-20)34-10-4-11-36-27)28(33)25-18-31(9-12-35-25)17-22-6-3-5-21-7-8-30-26(21)22/h3,5-8,13-14,19,25,30H,4,9-12,15-18H2,1-2H3	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	5.40	-11.7	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