BDBM50394700 CHEMBL2165630

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

InChI Key: InChIKey=SFWHKNCKBDIXLZ-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50394700   

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))	BDBM50394700 (CHEMBL2165630) Show SMILES Cc1nc(N)sc1CCCNC(=N)NC(=O)CCCCCCC(=O)NC(=N)NCCCc1sc(N)nc1C Show InChI InChI=1S/C24H40N10O2S2/c1-15-17(37-23(27)31-15)9-7-13-29-21(25)33-19(35)11-5-3-4-6-12-20(36)34-22(26)30-14-8-10-18-16(2)32-24(28)38-18/h3-14H2,1-2H3,(H2,27,31)(H2,28,32)(H3,25,29,33,35)(H3,26,30,34,36)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.245	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))	BDBM50394700 (CHEMBL2165630) Show SMILES Cc1nc(N)sc1CCCNC(=N)NC(=O)CCCCCCC(=O)NC(=N)NCCCc1sc(N)nc1C Show InChI InChI=1S/C24H40N10O2S2/c1-15-17(37-23(27)31-15)9-7-13-29-21(25)33-19(35)11-5-3-4-6-12-20(36)34-22(26)30-14-8-10-18-16(2)32-24(28)38-18/h3-14H2,1-2H3,(H2,27,31)(H2,28,32)(H3,25,29,33,35)(H3,26,30,34,36)	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	47.9	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))	BDBM50394700 (CHEMBL2165630) Show SMILES Cc1nc(N)sc1CCCNC(=N)NC(=O)CCCCCCC(=O)NC(=N)NCCCc1sc(N)nc1C Show InChI InChI=1S/C24H40N10O2S2/c1-15-17(37-23(27)31-15)9-7-13-29-21(25)33-19(35)11-5-3-4-6-12-20(36)34-22(26)30-14-8-10-18-16(2)32-24(28)38-18/h3-14H2,1-2H3,(H2,27,31)(H2,28,32)(H3,25,29,33,35)(H3,26,30,34,36)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.631	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
Histamine H2 receptor (Cavia porcellus (domestic guinea pig))	BDBM50394700 (CHEMBL2165630) Show SMILES Cc1nc(N)sc1CCCNC(=N)NC(=O)CCCCCCC(=O)NC(=N)NCCCc1sc(N)nc1C Show InChI InChI=1S/C24H40N10O2S2/c1-15-17(37-23(27)31-15)9-7-13-29-21(25)33-19(35)11-5-3-4-6-12-20(36)34-22(26)30-14-8-10-18-16(2)32-24(28)38-18/h3-14H2,1-2H3,(H2,27,31)(H2,28,32)(H3,25,29,33,35)(H3,26,30,34,36)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.630	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