BDBM50188164 4-[(2S)-2-amino-3-{[(2S)-1-amino-3-(4-hydroxyphenyl)propan-2-yl]amino}propyl]phenol::CHEMBL213418

SMILES: NC[C@H](Cc1ccc(O)cc1)NC[C@@H](N)Cc1ccc(O)cc1

InChI Key: InChIKey=SPKAVCGLKJPFLA-HOTGVXAUSA-N

Data: 2 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 2 hits for monomerid = 50188164   

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
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50188164 (4-[(2S)-2-amino-3-{[(2S)-1-amino-3-(4-hydroxypheny...) Show SMILES NC[C@H](Cc1ccc(O)cc1)NC[C@@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C18H25N3O2/c19-11-16(10-14-3-7-18(23)8-4-14)21-12-15(20)9-13-1-5-17(22)6-2-13/h1-8,15-16,21-23H,9-12,19-20H2/t15-,16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Molecular Studies Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from kappa opioid receptor				Bioorg Med Chem Lett 16: 4331-8 (2006) Article DOI: 10.1016/j.bmcl.2006.05.053 BindingDB Entry DOI: 10.7270/Q2028R47
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50188164 (4-[(2S)-2-amino-3-{[(2S)-1-amino-3-(4-hydroxypheny...) Show SMILES NC[C@H](Cc1ccc(O)cc1)NC[C@@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C18H25N3O2/c19-11-16(10-14-3-7-18(23)8-4-14)21-12-15(20)9-13-1-5-17(22)6-2-13/h1-8,15-16,21-23H,9-12,19-20H2/t15-,16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Molecular Studies Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from mu opioid receptor in rat brain homogenate				Bioorg Med Chem Lett 16: 4331-8 (2006) Article DOI: 10.1016/j.bmcl.2006.05.053 BindingDB Entry DOI: 10.7270/Q2028R47
					More data for this Ligand-Target Pair