BDBM50470924 CHEMBL122990

SMILES: Nc1ccc(CC2NCCc3cc(O)c(O)cc23)cc1I

InChI Key: InChIKey=QWTXDWOAXDXJFU-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50470924   

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))	BDBM50470924 (CHEMBL122990) Show SMILES Nc1ccc(CC2NCCc3cc(O)c(O)cc23)cc1I Show InChI InChI=1S/C16H17IN2O2/c17-12-5-9(1-2-13(12)18)6-14-11-8-16(21)15(20)7-10(11)3-4-19-14/h1-2,5,7-8,14,19-21H,3-4,6,18H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tennessee-Memphis Curated by ChEMBL					Assay Description Binding affinity for human Beta-2 adrenergic receptor expressed in CHO cells by radioligand competition binding assays using [125I]iodocyanopindolol ...				J Med Chem 39: 3701-11 (1996) Article DOI: 10.1021/jm960208o BindingDB Entry DOI: 10.7270/Q2Q52SBM
					More data for this Ligand-Target Pair
Thromboxane A2 receptor (Homo sapiens (Human))	BDBM50470924 (CHEMBL122990) Show SMILES Nc1ccc(CC2NCCc3cc(O)c(O)cc23)cc1I Show InChI InChI=1S/C16H17IN2O2/c17-12-5-9(1-2-13(12)18)6-14-11-8-16(21)15(20)7-10(11)3-4-19-14/h1-2,5,7-8,14,19-21H,3-4,6,18H2	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tennessee-Memphis Curated by ChEMBL					Assay Description Binding affinity for human Platelet Thromboxane A2 / Prostaglandin (TP), by radioligand competition binding assays using [3H]-SQ 29548 as radioligand				J Med Chem 39: 3701-11 (1996) Article DOI: 10.1021/jm960208o BindingDB Entry DOI: 10.7270/Q2Q52SBM
					More data for this Ligand-Target Pair