BDBM50293183 (R)-4-methyl-2-(2-(5-(quinoline-8-sulfonamido)-1H-indol-1-yl)acetamido)pentanoic acid::CHEMBL496585

SMILES: CC(C)C[C@@H](NC(=O)Cn1ccc2cc(NS(=O)(=O)c3cccc4cccnc34)ccc12)C(O)=O

InChI Key: InChIKey=WGDMUSXHIZFYNM-HXUWFJFHSA-N

Data: 1 KI  1 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 = 50293183   

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
Neurotensin receptor type 1 (Homo sapiens (Human))	BDBM50293183 ((R)-4-methyl-2-(2-(5-(quinoline-8-sulfonamido)-1H-...) Show SMILES CC(C)C[C@@H](NC(=O)Cn1ccc2cc(NS(=O)(=O)c3cccc4cccnc34)ccc12)C(O)=O |r| Show InChI InChI=1S/C25H26N4O5S/c1-16(2)13-20(25(31)32)27-23(30)15-29-12-10-18-14-19(8-9-21(18)29)28-35(33,34)22-7-3-5-17-6-4-11-26-24(17)22/h3-12,14,16,20,28H,13,15H2,1-2H3,(H,27,30)(H,31,32)/t20-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	545	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of [3H]neurotensin from human NTS1 receptor expressed in CHOK1 cells after 60 mins by beta plate liquid scintillation counter				Bioorg Med Chem Lett 18: 5789-91 (2009) Article DOI: 10.1016/j.bmcl.2008.09.075 BindingDB Entry DOI: 10.7270/Q24X57S8
					More data for this Ligand-Target Pair
Neurotensin receptor type 1 (Homo sapiens (Human))	BDBM50293183 ((R)-4-methyl-2-(2-(5-(quinoline-8-sulfonamido)-1H-...) Show SMILES CC(C)C[C@@H](NC(=O)Cn1ccc2cc(NS(=O)(=O)c3cccc4cccnc34)ccc12)C(O)=O |r| Show InChI InChI=1S/C25H26N4O5S/c1-16(2)13-20(25(31)32)27-23(30)15-29-12-10-18-14-19(8-9-21(18)29)28-35(33,34)22-7-3-5-17-6-4-11-26-24(17)22/h3-12,14,16,20,28H,13,15H2,1-2H3,(H,27,30)(H,31,32)/t20-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.76	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Antagonist activity at human NTS1 receptor expressed in CHOK1 cells assessed as inhibition of intracellular calcium elevation pretreated 30 mins befo...				Bioorg Med Chem Lett 18: 5789-91 (2009) Article DOI: 10.1016/j.bmcl.2008.09.075 BindingDB Entry DOI: 10.7270/Q24X57S8
					More data for this Ligand-Target Pair
Neurotensin receptor type 1 (Homo sapiens (Human))	BDBM50293183 ((R)-4-methyl-2-(2-(5-(quinoline-8-sulfonamido)-1H-...) Show SMILES CC(C)C[C@@H](NC(=O)Cn1ccc2cc(NS(=O)(=O)c3cccc4cccnc34)ccc12)C(O)=O |r| Show InChI InChI=1S/C25H26N4O5S/c1-16(2)13-20(25(31)32)27-23(30)15-29-12-10-18-14-19(8-9-21(18)29)28-35(33,34)22-7-3-5-17-6-4-11-26-24(17)22/h3-12,14,16,20,28H,13,15H2,1-2H3,(H,27,30)(H,31,32)/t20-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.78E+5	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Agonist activity at NTSR1 (unknown origin) expressed in CHO cells assessed as potentiation of NT(8-13) peptide-induced change in intracellular Ca2+ l...				Bioorg Med Chem Lett 24: 3974-8 (2014) Article DOI: 10.1016/j.bmcl.2014.06.033 BindingDB Entry DOI: 10.7270/Q2ZP47RG
					More data for this Ligand-Target Pair
Neurotensin receptor type 1 (Homo sapiens (Human))	BDBM50293183 ((R)-4-methyl-2-(2-(5-(quinoline-8-sulfonamido)-1H-...) Show SMILES CC(C)C[C@@H](NC(=O)Cn1ccc2cc(NS(=O)(=O)c3cccc4cccnc34)ccc12)C(O)=O |r| Show InChI InChI=1S/C25H26N4O5S/c1-16(2)13-20(25(31)32)27-23(30)15-29-12-10-18-14-19(8-9-21(18)29)28-35(33,34)22-7-3-5-17-6-4-11-26-24(17)22/h3-12,14,16,20,28H,13,15H2,1-2H3,(H,27,30)(H,31,32)/t20-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.78E+5	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Agonist activity at human NTS1 receptor expressed in CHOK1 cells assessed as increase in intracellular calcium level by FLIPR assay				Bioorg Med Chem Lett 18: 5789-91 (2009) Article DOI: 10.1016/j.bmcl.2008.09.075 BindingDB Entry DOI: 10.7270/Q24X57S8
					More data for this Ligand-Target Pair