BDBM50539159 CHEMBL4649725

SMILES: Oc1ccc(cc1)-c1cc2CCC(CCc2s1)NCCCc1ccccc1

InChI Key: InChIKey=AXGBTJWSECLUHH-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 = 50539159   

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
Glutamate receptor ionotropic, NMDA 2B (Homo sapiens (Human))	BDBM50539159 (CHEMBL4649725) Show SMILES Oc1ccc(cc1)-c1cc2CCC(CCc2s1)NCCCc1ccccc1 Show InChI InChI=1S/C24H27NOS/c26-22-13-9-19(10-14-22)24-17-20-8-11-21(12-15-23(20)27-24)25-16-4-7-18-5-2-1-3-6-18/h1-3,5-6,9-10,13-14,17,21,25-26H,4,7-8,11-12,15-16H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Westf£lische Wilhelms-Universit£t M£nster Curated by ChEMBL					Assay Description Displacement of [3H]ifenprodil from human recombinant GluN2B expressed in mouse L(tk-) cell membranes co-expressing GluN1a incubated for 120 mins by ...				Bioorg Med Chem 28: (2020)
					More data for this Ligand-Target Pair
Sigma intracellular receptor 2 (Rattus norvegicus (Rat))	BDBM50539159 (CHEMBL4649725) Show SMILES Oc1ccc(cc1)-c1cc2CCC(CCc2s1)NCCCc1ccccc1 Show InChI InChI=1S/C24H27NOS/c26-22-13-9-19(10-14-22)24-17-20-8-11-21(12-15-23(20)27-24)25-16-4-7-18-5-2-1-3-6-18/h1-3,5-6,9-10,13-14,17,21,25-26H,4,7-8,11-12,15-16H2	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Westf£lische Wilhelms-Universit£t M£nster Curated by ChEMBL					Assay Description Displacement of [3H]-di-o-tolylguanidine from sigma2 receptor in rat liver membranes incubated for 120 mins in the presence of sigma1 receptor ligand...				Bioorg Med Chem 28: (2020)
					More data for this Ligand-Target Pair
Sigma-1 receptor (Cavia porcellus (Guinea pig))	BDBM50539159 (CHEMBL4649725) Show SMILES Oc1ccc(cc1)-c1cc2CCC(CCc2s1)NCCCc1ccccc1 Show InChI InChI=1S/C24H27NOS/c26-22-13-9-19(10-14-22)24-17-20-8-11-21(12-15-23(20)27-24)25-16-4-7-18-5-2-1-3-6-18/h1-3,5-6,9-10,13-14,17,21,25-26H,4,7-8,11-12,15-16H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	181	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Westf£lische Wilhelms-Universit£t M£nster Curated by ChEMBL					Assay Description Displacement of [3H]-(+)-pentazocine from sigma1 receptor in guinea pig brain membranes incubated for 120 mins by scintillation counting method				Bioorg Med Chem 28: (2020)
					More data for this Ligand-Target Pair