BDBM50544350 CHEMBL4645625

SMILES: CN(C)CCNC(=O)[C@H]1CN(C[C@@H]1NC(=O)c1cc2cc(C)ccc2[nH]1)S(=O)(=O)c1cn(C)nc1C

InChI Key: InChIKey=FBOHOAYONHCVIJ-RXVVDRJESA-N

Data: 2 IC50  2 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 = 50544350   

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
Ghrelin receptor (Homo sapiens (Human))	BDBM50544350 (CHEMBL4645625) Show SMILES CN(C)CCNC(=O)[C@H]1CN(C[C@@H]1NC(=O)c1cc2cc(C)ccc2[nH]1)S(=O)(=O)c1cn(C)nc1C |r| Show InChI InChI=1S/C24H33N7O4S/c1-15-6-7-19-17(10-15)11-20(26-19)24(33)27-21-13-31(12-18(21)23(32)25-8-9-29(3)4)36(34,35)22-14-30(5)28-16(22)2/h6-7,10-11,14,18,21,26H,8-9,12-13H2,1-5H3,(H,25,32)(H,27,33)/t18-,21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Displacement of [His[125I]]-ghrelin from GHS-R1a (unknown origin) expressed in HEK293 cell membranes measured after 1 hr by microbeta counting method				J Med Chem 63: 9705-9730 (2020)
					More data for this Ligand-Target Pair
Ghrelin receptor (Homo sapiens (Human))	BDBM50544350 (CHEMBL4645625) Show SMILES CN(C)CCNC(=O)[C@H]1CN(C[C@@H]1NC(=O)c1cc2cc(C)ccc2[nH]1)S(=O)(=O)c1cn(C)nc1C |r| Show InChI InChI=1S/C24H33N7O4S/c1-15-6-7-19-17(10-15)11-20(26-19)24(33)27-21-13-31(12-18(21)23(32)25-8-9-29(3)4)36(34,35)22-14-30(5)28-16(22)2/h6-7,10-11,14,18,21,26H,8-9,12-13H2,1-5H3,(H,25,32)(H,27,33)/t18-,21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	2.90	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Agonist activity at human GHSR expressed in HEK293 cells assessed as increase in IP1 accumulation measured after 90 mins in presence of LiCl by HTRF ...				J Med Chem 63: 9705-9730 (2020)
					More data for this Ligand-Target Pair
Ghrelin receptor (Homo sapiens (Human))	BDBM50544350 (CHEMBL4645625) Show SMILES CN(C)CCNC(=O)[C@H]1CN(C[C@@H]1NC(=O)c1cc2cc(C)ccc2[nH]1)S(=O)(=O)c1cn(C)nc1C |r| Show InChI InChI=1S/C24H33N7O4S/c1-15-6-7-19-17(10-15)11-20(26-19)24(33)27-21-13-31(12-18(21)23(32)25-8-9-29(3)4)36(34,35)22-14-30(5)28-16(22)2/h6-7,10-11,14,18,21,26H,8-9,12-13H2,1-5H3,(H,25,32)(H,27,33)/t18-,21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	3.20	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Agonist activity at human GHSR expressed in HEK293 cells assessed as increase in IP1 accumulation measured after 90 mins in presence of LiCl by HTRF ...				J Med Chem 63: 9705-9730 (2020)
					More data for this Ligand-Target Pair
Ghrelin receptor (Homo sapiens (Human))	BDBM50544350 (CHEMBL4645625) Show SMILES CN(C)CCNC(=O)[C@H]1CN(C[C@@H]1NC(=O)c1cc2cc(C)ccc2[nH]1)S(=O)(=O)c1cn(C)nc1C |r| Show InChI InChI=1S/C24H33N7O4S/c1-15-6-7-19-17(10-15)11-20(26-19)24(33)27-21-13-31(12-18(21)23(32)25-8-9-29(3)4)36(34,35)22-14-30(5)28-16(22)2/h6-7,10-11,14,18,21,26H,8-9,12-13H2,1-5H3,(H,25,32)(H,27,33)/t18-,21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Displacement of [His[125I]]-ghrelin from GHS-R1a (unknown origin) expressed in HEK293 cell membranes measured after 1 hr by microbeta counting method				J Med Chem 63: 9705-9730 (2020)
					More data for this Ligand-Target Pair