BDBM50423354 CHEMBL440233

SMILES: COc1cccc2C[C@@H]3[C@H](C[C@H](CN3C)C(=O)N3CCN(CC3)c3ccc(cn3)C#N)Cc12

InChI Key: InChIKey=UBKRRUJKVYCFGQ-MQSCRBSSSA-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 = 50423354   

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)	BDBM50423354 (CHEMBL440233) Show SMILES COc1cccc2C[C@@H]3[C@H](C[C@H](CN3C)C(=O)N3CCN(CC3)c3ccc(cn3)C#N)Cc12 Show InChI InChI=1S/C26H31N5O2/c1-29-17-21(12-20-13-22-19(14-23(20)29)4-3-5-24(22)33-2)26(32)31-10-8-30(9-11-31)25-7-6-18(15-27)16-28-25/h3-7,16,20-21,23H,8-14,17H2,1-2H3/t20-,21-,23-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.02E+4	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 rat sst2 receptor from rat brain cortex membrane				Bioorg Med Chem Lett 17: 3988-91 (2007) Article DOI: 10.1016/j.bmcl.2007.04.078 BindingDB Entry DOI: 10.7270/Q2SX6FHF
					More data for this Ligand-Target Pair
SSTR1 (RAT)	BDBM50423354 (CHEMBL440233) Show SMILES COc1cccc2C[C@@H]3[C@H](C[C@H](CN3C)C(=O)N3CCN(CC3)c3ccc(cn3)C#N)Cc12 Show InChI InChI=1S/C26H31N5O2/c1-29-17-21(12-20-13-22-19(14-23(20)29)4-3-5-24(22)33-2)26(32)31-10-8-30(9-11-31)25-7-6-18(15-27)16-28-25/h3-7,16,20-21,23H,8-14,17H2,1-2H3/t20-,21-,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	3.60	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 rat sst1 receptor from rat brain cortex membrane				Bioorg Med Chem Lett 17: 3988-91 (2007) Article DOI: 10.1016/j.bmcl.2007.04.078 BindingDB Entry DOI: 10.7270/Q2SX6FHF
					More data for this Ligand-Target Pair