BDBM50096825 (S)-6-Amino-2-{(S)-3-(1H-indol-3-yl)-2-[(1-isobutyryl-piperidine-4-carbonyl)-amino]-butyrylamino}-hexanoic acid tert-butyl ester::CHEMBL335223

SMILES: CC(C)C(=O)N1CCC(CC1)C(=O)NC([C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)OC(C)(C)C

InChI Key: InChIKey=VZSXZFYCTCSIIL-HNJDVHBFSA-N

Data: 3 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 3 hits for monomerid = 50096825   

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 2 (Homo sapiens (Human))	BDBM50096825 ((S)-6-Amino-2-{(S)-3-(1H-indol-3-yl)-2-[(1-isobuty...) Show SMILES CC(C)C(=O)N1CCC(CC1)C(=O)NC([C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)OC(C)(C)C Show InChI InChI=1S/C32H49N5O5/c1-20(2)30(40)37-17-14-22(15-18-37)28(38)36-27(21(3)24-19-34-25-12-8-7-11-23(24)25)29(39)35-26(13-9-10-16-33)31(41)42-32(4,5)6/h7-8,11-12,19-22,26-27,34H,9-10,13-18,33H2,1-6H3,(H,35,39)(H,36,38)/t21-,26-,27?/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity of the compound to Somatostatin receptor type 2 was determined				Bioorg Med Chem Lett 11: 415-7 (2001) BindingDB Entry DOI: 10.7270/Q2474949
					More data for this Ligand-Target Pair
Somatostatin receptor type 5 (Homo sapiens (Human))	BDBM50096825 ((S)-6-Amino-2-{(S)-3-(1H-indol-3-yl)-2-[(1-isobuty...) Show SMILES CC(C)C(=O)N1CCC(CC1)C(=O)NC([C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)OC(C)(C)C Show InChI InChI=1S/C32H49N5O5/c1-20(2)30(40)37-17-14-22(15-18-37)28(38)36-27(21(3)24-19-34-25-12-8-7-11-23(24)25)29(39)35-26(13-9-10-16-33)31(41)42-32(4,5)6/h7-8,11-12,19-22,26-27,34H,9-10,13-18,33H2,1-6H3,(H,35,39)(H,36,38)/t21-,26-,27?/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.86E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity of the compound to hsst5 was determined				Bioorg Med Chem Lett 11: 415-7 (2001) BindingDB Entry DOI: 10.7270/Q2474949
					More data for this Ligand-Target Pair
Somatostatin receptor type 3 (Homo sapiens (Human))	BDBM50096825 ((S)-6-Amino-2-{(S)-3-(1H-indol-3-yl)-2-[(1-isobuty...) Show SMILES CC(C)C(=O)N1CCC(CC1)C(=O)NC([C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)OC(C)(C)C Show InChI InChI=1S/C32H49N5O5/c1-20(2)30(40)37-17-14-22(15-18-37)28(38)36-27(21(3)24-19-34-25-12-8-7-11-23(24)25)29(39)35-26(13-9-10-16-33)31(41)42-32(4,5)6/h7-8,11-12,19-22,26-27,34H,9-10,13-18,33H2,1-6H3,(H,35,39)(H,36,38)/t21-,26-,27?/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.25E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity of the compound to hsst3 was determined				Bioorg Med Chem Lett 11: 415-7 (2001) BindingDB Entry DOI: 10.7270/Q2474949
					More data for this Ligand-Target Pair