BDBM50070133 4-((2S)-2-{[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino}propyl)phenol::CHEMBL12633

SMILES: C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)COc1ccc(O)cc1

InChI Key: InChIKey=PVUVQUOENNZKFE-GUYCJALGSA-N

Data: 2 IC50  1 EC50

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 = 50070133   

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
Beta-2 adrenergic receptor (Homo sapiens (Human))	BDBM50070133 (4-((2S)-2-{[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)pro...) Show SMILES C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)COc1ccc(O)cc1 Show InChI InChI=1S/C18H23NO4/c1-13(10-14-2-4-15(20)5-3-14)19-11-17(22)12-23-18-8-6-16(21)7-9-18/h2-9,13,17,19-22H,10-12H2,1H3/t13-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	84	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity against cloned human beta-2 adrenergic receptor from CHO cells using [125I]-iodocyanopindolol as the radioligand				Bioorg Med Chem Lett 8: 1101-6 (1999) BindingDB Entry DOI: 10.7270/Q2VM4BDM
					More data for this Ligand-Target Pair
Beta-1 adrenergic receptor (Homo sapiens (Human))	BDBM50070133 (4-((2S)-2-{[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)pro...) Show SMILES C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)COc1ccc(O)cc1 Show InChI InChI=1S/C18H23NO4/c1-13(10-14-2-4-15(20)5-3-14)19-11-17(22)12-23-18-8-6-16(21)7-9-18/h2-9,13,17,19-22H,10-12H2,1H3/t13-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	81	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Tested for binding affinity against cloned human beta-1 adrenergic receptor from CHO cells using [125I]-iodocyanopindolol as the radioligand				Bioorg Med Chem Lett 8: 1101-6 (1999) BindingDB Entry DOI: 10.7270/Q2VM4BDM
					More data for this Ligand-Target Pair
Beta-3 adrenergic receptor (Homo sapiens (Human))	BDBM50070133 (4-((2S)-2-{[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)pro...) Show SMILES C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)COc1ccc(O)cc1 Show InChI InChI=1S/C18H23NO4/c1-13(10-14-2-4-15(20)5-3-14)19-11-17(22)12-23-18-8-6-16(21)7-9-18/h2-9,13,17,19-22H,10-12H2,1H3/t13-,17-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	25	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity against cloned human beta-3 adrenergic receptor				Bioorg Med Chem Lett 8: 1101-6 (1999) BindingDB Entry DOI: 10.7270/Q2VM4BDM
					More data for this Ligand-Target Pair