BDBM50254244 (5S)-5-[(4R)-4-(benzoylamino)-3-oxo-3,4,5,10-tetrahydroazepino[3,4-b]indol-2(1H)-yl]-6-(benzylamino)-6-oxohexan-1-aminium trifluoroacetate::CHEMBL504930

SMILES: NCCCC[C@H](N1Cc2[nH]c3ccccc3c2C[C@@H](NC(=O)c2ccccc2)C1=O)C(=O)NCc1ccccc1

InChI Key: InChIKey=JDDMXKAYWDTJMD-PXJZQJOASA-N

Data: 5 IC50

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 5 hits for monomerid = 50254244   

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
Somatostatin receptor type 5 (Homo sapiens (Human))	BDBM50254244 ((5S)-5-[(4R)-4-(benzoylamino)-3-oxo-3,4,5,10-tetra...) Show SMILES NCCCC[C@H](N1Cc2[nH]c3ccccc3c2C[C@@H](NC(=O)c2ccccc2)C1=O)C(=O)NCc1ccccc1 |r| Show InChI InChI=1S/C32H35N5O3/c33-18-10-9-17-29(31(39)34-20-22-11-3-1-4-12-22)37-21-28-25(24-15-7-8-16-26(24)35-28)19-27(32(37)40)36-30(38)23-13-5-2-6-14-23/h1-8,11-16,27,29,35H,9-10,17-21,33H2,(H,34,39)(H,36,38)/t27-,29+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Brussel Curated by ChEMBL					Assay Description Displacement of [125I]-[Leu8, DTrp22, Tyr25]-somatostatin-28 from human recombinant sst5 receptor expressed in chinese hamster CCL39 cells				J Med Chem 52: 95-104 (2009) Article DOI: 10.1021/jm801205x BindingDB Entry DOI: 10.7270/Q27W6D3B
					More data for this Ligand-Target Pair
Somatostatin receptor type 1 (Homo sapiens (Human))	BDBM50254244 ((5S)-5-[(4R)-4-(benzoylamino)-3-oxo-3,4,5,10-tetra...) Show SMILES NCCCC[C@H](N1Cc2[nH]c3ccccc3c2C[C@@H](NC(=O)c2ccccc2)C1=O)C(=O)NCc1ccccc1 |r| Show InChI InChI=1S/C32H35N5O3/c33-18-10-9-17-29(31(39)34-20-22-11-3-1-4-12-22)37-21-28-25(24-15-7-8-16-26(24)35-28)19-27(32(37)40)36-30(38)23-13-5-2-6-14-23/h1-8,11-16,27,29,35H,9-10,17-21,33H2,(H,34,39)(H,36,38)/t27-,29+/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Brussel Curated by ChEMBL					Assay Description Displacement of [125I]-[Leu8, DTrp22, Tyr25]-somatostatin-28 from human recombinant sst1 receptor expressed in chinese hamster CCL39 cells				J Med Chem 52: 95-104 (2009) Article DOI: 10.1021/jm801205x BindingDB Entry DOI: 10.7270/Q27W6D3B
					More data for this Ligand-Target Pair
Somatostatin receptor type 4 (Homo sapiens (Human))	BDBM50254244 ((5S)-5-[(4R)-4-(benzoylamino)-3-oxo-3,4,5,10-tetra...) Show SMILES NCCCC[C@H](N1Cc2[nH]c3ccccc3c2C[C@@H](NC(=O)c2ccccc2)C1=O)C(=O)NCc1ccccc1 |r| Show InChI InChI=1S/C32H35N5O3/c33-18-10-9-17-29(31(39)34-20-22-11-3-1-4-12-22)37-21-28-25(24-15-7-8-16-26(24)35-28)19-27(32(37)40)36-30(38)23-13-5-2-6-14-23/h1-8,11-16,27,29,35H,9-10,17-21,33H2,(H,34,39)(H,36,38)/t27-,29+/m1/s1	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Brussel Curated by ChEMBL					Assay Description Displacement of [125I]-[Leu8, DTrp22, Tyr25]-somatostatin-28 from human recombinant sst4 receptor expressed in chinese hamster CCL39 cells				J Med Chem 52: 95-104 (2009) Article DOI: 10.1021/jm801205x BindingDB Entry DOI: 10.7270/Q27W6D3B
					More data for this Ligand-Target Pair
Somatostatin receptor type 3 (Homo sapiens (Human))	BDBM50254244 ((5S)-5-[(4R)-4-(benzoylamino)-3-oxo-3,4,5,10-tetra...) Show SMILES NCCCC[C@H](N1Cc2[nH]c3ccccc3c2C[C@@H](NC(=O)c2ccccc2)C1=O)C(=O)NCc1ccccc1 |r| Show InChI InChI=1S/C32H35N5O3/c33-18-10-9-17-29(31(39)34-20-22-11-3-1-4-12-22)37-21-28-25(24-15-7-8-16-26(24)35-28)19-27(32(37)40)36-30(38)23-13-5-2-6-14-23/h1-8,11-16,27,29,35H,9-10,17-21,33H2,(H,34,39)(H,36,38)/t27-,29+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	182	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Brussel Curated by ChEMBL					Assay Description Displacement of [125I]-[Leu8, DTrp22, Tyr25]-somatostatin-28 from human recombinant sst3 receptor expressed in chinese hamster CCL39 cells				J Med Chem 52: 95-104 (2009) Article DOI: 10.1021/jm801205x BindingDB Entry DOI: 10.7270/Q27W6D3B
					More data for this Ligand-Target Pair
Somatostatin receptor type 2 (Homo sapiens (Human))	BDBM50254244 ((5S)-5-[(4R)-4-(benzoylamino)-3-oxo-3,4,5,10-tetra...) Show SMILES NCCCC[C@H](N1Cc2[nH]c3ccccc3c2C[C@@H](NC(=O)c2ccccc2)C1=O)C(=O)NCc1ccccc1 |r| Show InChI InChI=1S/C32H35N5O3/c33-18-10-9-17-29(31(39)34-20-22-11-3-1-4-12-22)37-21-28-25(24-15-7-8-16-26(24)35-28)19-27(32(37)40)36-30(38)23-13-5-2-6-14-23/h1-8,11-16,27,29,35H,9-10,17-21,33H2,(H,34,39)(H,36,38)/t27-,29+/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	103	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Brussel Curated by ChEMBL					Assay Description Displacement of [125I]-[Leu8, DTrp22, Tyr25]-somatostatin-28 from human recombinant sst2 receptor expressed in chinese hamster CCL39 cells				J Med Chem 52: 95-104 (2009) Article DOI: 10.1021/jm801205x BindingDB Entry DOI: 10.7270/Q27W6D3B
					More data for this Ligand-Target Pair