BDBM50268378 (S)-2-amino-N-((3S,6S)-3-(3-tert-butyl-4-hydroxybenzyl)-2,5,12-trioxo-1,4-diazacyclotetradecan-6-yl)-3-phenylpropanamide::CHEMBL526496

SMILES: CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@H](CCCCCC(=O)CCNC2=O)NC(=O)[C@@H](N)Cc2ccccc2)ccc1O

InChI Key: InChIKey=JTQNSWFLFZHZQN-QKDODKLFSA-N

Data: 1 IC50  1 Kd

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 = 50268378   

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
Motilin receptor (Oryctolagus cuniculus)	BDBM50268378 ((S)-2-amino-N-((3S,6S)-3-(3-tert-butyl-4-hydroxybe...) Show SMILES CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@H](CCCCCC(=O)CCNC2=O)NC(=O)[C@@H](N)Cc2ccccc2)ccc1O |r| Show InChI InChI=1S/C32H44N4O5/c1-32(2,3)24-18-22(14-15-28(24)38)20-27-30(40)34-17-16-23(37)12-8-5-9-13-26(31(41)36-27)35-29(39)25(33)19-21-10-6-4-7-11-21/h4,6-7,10-11,14-15,18,25-27,38H,5,8-9,12-13,16-17,19-20,33H2,1-3H3,(H,34,40)(H,35,39)(H,36,41)/t25-,26-,27-/m0/s1	Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	39.8	n/a	n/a	n/a	n/a	n/a
Chugai Pharmaceutical Co. Ltd Curated by ChEMBL					Assay Description Antagonist activity at MTL receptor in rabbit duodenum homogenate				Bioorg Med Chem Lett 19: 3426-9 (2009) Article DOI: 10.1016/j.bmcl.2009.05.059 BindingDB Entry DOI: 10.7270/Q2445MCH
					More data for this Ligand-Target Pair
Motilin receptor (Oryctolagus cuniculus)	BDBM50268378 ((S)-2-amino-N-((3S,6S)-3-(3-tert-butyl-4-hydroxybe...) Show SMILES CC(C)(C)c1cc(C[C@@H]2NC(=O)[C@H](CCCCCC(=O)CCNC2=O)NC(=O)[C@@H](N)Cc2ccccc2)ccc1O |r| Show InChI InChI=1S/C32H44N4O5/c1-32(2,3)24-18-22(14-15-28(24)38)20-27-30(40)34-17-16-23(37)12-8-5-9-13-26(31(41)36-27)35-29(39)25(33)19-21-10-6-4-7-11-21/h4,6-7,10-11,14-15,18,25-27,38H,5,8-9,12-13,16-17,19-20,33H2,1-3H3,(H,34,40)(H,35,39)(H,36,41)/t25-,26-,27-/m0/s1	Reactome pathway KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Chugai Pharmaceutical Co. Ltd Curated by ChEMBL					Assay Description Displacement of [125I]motilin from MTL receptor in rabbit duodenum homogenate				Bioorg Med Chem Lett 19: 3426-9 (2009) Article DOI: 10.1016/j.bmcl.2009.05.059 BindingDB Entry DOI: 10.7270/Q2445MCH
					More data for this Ligand-Target Pair