BDBM50423313 CHEMBL249111

SMILES: COc1ccc(C(C)=O)c2C[C@@H]3[C@H](C[C@H](CN3C)C(=O)N3CCN(CC3)c3ccc4nsnc4n3)Cc12

InChI Key: InChIKey=GBBWPPZDGCIUKR-PMAPCBKXSA-N

Data: 2 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 = 50423313   

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
SSTR2 (RAT)	BDBM50423313 (CHEMBL249111) Show SMILES COc1ccc(C(C)=O)c2C[C@@H]3[C@H](C[C@H](CN3C)C(=O)N3CCN(CC3)c3ccc4nsnc4n3)Cc12 Show InChI InChI=1S/C27H32N6O3S/c1-16(34)19-4-6-24(36-3)21-13-17-12-18(15-31(2)23(17)14-20(19)21)27(35)33-10-8-32(9-11-33)25-7-5-22-26(28-25)30-37-29-22/h4-7,17-18,23H,8-15H2,1-3H3/t17-,18-,23-/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.88E+3	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Displacement of [125I]SRIF14 from sst2 receptor in rat brain cortex membrane				Bioorg Med Chem Lett 17: 3983-7 (2007) Article DOI: 10.1016/j.bmcl.2007.04.086 BindingDB Entry DOI: 10.7270/Q2XP7675
					More data for this Ligand-Target Pair
SSTR1 (RAT)	BDBM50423313 (CHEMBL249111) Show SMILES COc1ccc(C(C)=O)c2C[C@@H]3[C@H](C[C@H](CN3C)C(=O)N3CCN(CC3)c3ccc4nsnc4n3)Cc12 Show InChI InChI=1S/C27H32N6O3S/c1-16(34)19-4-6-24(36-3)21-13-17-12-18(15-31(2)23(17)14-20(19)21)27(35)33-10-8-32(9-11-33)25-7-5-22-26(28-25)30-37-29-22/h4-7,17-18,23H,8-15H2,1-3H3/t17-,18-,23-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a
Novartis Institutes for BioMedical Research Curated by ChEMBL					Assay Description Displacement of [125I]SRIF14 from sst1 receptor in rat brain cortex membrane				Bioorg Med Chem Lett 17: 3983-7 (2007) Article DOI: 10.1016/j.bmcl.2007.04.086 BindingDB Entry DOI: 10.7270/Q2XP7675
					More data for this Ligand-Target Pair