BDBM50206704 CHEMBL3924268

SMILES: CC[C@H](C)[C@H](NC(=O)[C@@]1(CCO[C@@H]1c1ccc(Br)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(O)=O

InChI Key: InChIKey=VBXPVGZTIVEQAY-XSQOBMHJSA-N

Data: 2 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 2 hits for monomerid = 50206704   

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 (Homo sapiens (Human))	BDBM50206704 (CHEMBL3924268) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@]1(CCO[C@@H]1c1ccc(Br)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(O)=O |r| Show InChI InChI=1S/C40H65BrN8O8/c1-5-25(4)32(36(52)46-30(38(54)55)23-24(2)3)47-39(56)40(18-22-57-33(40)26-14-16-27(41)17-15-26)48-35(51)31-13-10-21-49(31)37(53)29(12-7-9-20-43)45-34(50)28(44)11-6-8-19-42/h14-17,24-25,28-33H,5-13,18-23,42-44H2,1-4H3,(H,45,50)(H,46,52)(H,47,56)(H,48,51)(H,54,55)/t25-,28-,29-,30-,31-,32-,33+,40-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	227	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Displacement of [leucine-3H]NT (8 to 13 residues) from human NTS2 receptor expressed in HEK293 cell membranes after 60 mins by scintillation counting				Bioorg Med Chem 25: 350-359 (2017) Article DOI: 10.1016/j.bmc.2016.10.039 BindingDB Entry DOI: 10.7270/Q2DR2XG4
					More data for this Ligand-Target Pair
Dopamine receptor D2L/neurotensin receptor NTS1 (Homo sapiens (Human))	BDBM50206704 (CHEMBL3924268) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@]1(CCO[C@@H]1c1ccc(Br)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(O)=O |r| Show InChI InChI=1S/C40H65BrN8O8/c1-5-25(4)32(36(52)46-30(38(54)55)23-24(2)3)47-39(56)40(18-22-57-33(40)26-14-16-27(41)17-15-26)48-35(51)31-13-10-21-49(31)37(53)29(12-7-9-20-43)45-34(50)28(44)11-6-8-19-42/h14-17,24-25,28-33H,5-13,18-23,42-44H2,1-4H3,(H,45,50)(H,46,52)(H,47,56)(H,48,51)(H,54,55)/t25-,28-,29-,30-,31-,32-,33+,40-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Regensburg Curated by ChEMBL					Assay Description Displacement of [3H]neurotensin from human NTS1 receptor expressed in CHOK1 cell membranes after 60 mins by scintillation counting				Bioorg Med Chem 25: 350-359 (2017) Article DOI: 10.1016/j.bmc.2016.10.039 BindingDB Entry DOI: 10.7270/Q2DR2XG4
					More data for this Ligand-Target Pair