BDBM50394696 CHEMBL2165634

SMILES: Cc1nc(N)sc1CCCNC(=N)NC(=O)CCCCCCCCCCCCCCC(=O)NC(=N)NCCCc1sc(N)nc1C

InChI Key: InChIKey=OGDYCPQMQHJZLZ-UHFFFAOYSA-N

Data: 3 EC50

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 = 50394696   

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
Histamine H2 receptor (Cavia porcellus (domestic guinea pig))	BDBM50394696 (CHEMBL2165634) Show SMILES Cc1nc(N)sc1CCCNC(=N)NC(=O)CCCCCCCCCCCCCCC(=O)NC(=N)NCCCc1sc(N)nc1C Show InChI InChI=1S/C32H56N10O2S2/c1-23-25(45-31(35)39-23)17-15-21-37-29(33)41-27(43)19-13-11-9-7-5-3-4-6-8-10-12-14-20-28(44)42-30(34)38-22-16-18-26-24(2)40-32(36)46-26/h3-22H2,1-2H3,(H2,35,39)(H2,36,40)(H3,33,37,41,43)(H3,34,38,42,44)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	550	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Agonist activity at H2R in spontaneously beating guinea pig right atrium assessed as increase in heart rate				J Med Chem 55: 1147-60 (2012) Article DOI: 10.1021/jm201128q BindingDB Entry DOI: 10.7270/Q2HQ411W
					More data for this Ligand-Target Pair
Histamine H2 Receptor (Homo sapiens (Human))	BDBM50394696 (CHEMBL2165634) Show SMILES Cc1nc(N)sc1CCCNC(=N)NC(=O)CCCCCCCCCCCCCCC(=O)NC(=N)NCCCc1sc(N)nc1C Show InChI InChI=1S/C32H56N10O2S2/c1-23-25(45-31(35)39-23)17-15-21-37-29(33)41-27(43)19-13-11-9-7-5-3-4-6-8-10-12-14-20-28(44)42-30(34)38-22-16-18-26-24(2)40-32(36)46-26/h3-22H2,1-2H3,(H2,35,39)(H2,36,40)(H3,33,37,41,43)(H3,34,38,42,44)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	25.7	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Agonist activity at human H2R-Gsalphas expressed in Sf9 cells at 0.1 nM to 10 uM by steady state GTPase activity assay				J Med Chem 55: 1147-60 (2012) Article DOI: 10.1021/jm201128q BindingDB Entry DOI: 10.7270/Q2HQ411W
					More data for this Ligand-Target Pair
Histamine H2 receptor (Cavia porcellus (domestic guinea pig))	BDBM50394696 (CHEMBL2165634) Show SMILES Cc1nc(N)sc1CCCNC(=N)NC(=O)CCCCCCCCCCCCCCC(=O)NC(=N)NCCCc1sc(N)nc1C Show InChI InChI=1S/C32H56N10O2S2/c1-23-25(45-31(35)39-23)17-15-21-37-29(33)41-27(43)19-13-11-9-7-5-3-4-6-8-10-12-14-20-28(44)42-30(34)38-22-16-18-26-24(2)40-32(36)46-26/h3-22H2,1-2H3,(H2,35,39)(H2,36,40)(H3,33,37,41,43)(H3,34,38,42,44)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	34.7	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Agonist activity at guinea pig H2R-Gsalphas expressed in Sf9 cells at 0.1 nM to 10 uM by steady state GTPase activity assay				J Med Chem 55: 1147-60 (2012) Article DOI: 10.1021/jm201128q BindingDB Entry DOI: 10.7270/Q2HQ411W
					More data for this Ligand-Target Pair