BDBM25767 Timolol::racemic-Timolol::tert-butyl(2-hydroxy-3-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}propyl)amine

SMILES: CC(C)(C)NC[C@@H](COc1c(nsn1)N2CCOCC2)O

InChI Key: InChIKey=BLJRIMJGRPQVNF-UHFFFAOYSA-N

Data: 1 IC50  3 Kd

PDB links: 3 PDB IDs match this monomer.

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 4 hits for monomerid = 25767   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Beta-1 adrenergic receptor (Human)	BDBM25767 (tert-butyl(2-hydroxy-3-{[4-(morpholin-4-yl)-1,2,5-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	5.35	n/a	n/a	n/a	7.4	37
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Beta-2 adrenergic receptor (Human)	BDBM25767 (tert-butyl(2-hydroxy-3-{[4-(morpholin-4-yl)-1,2,5-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	0.210	n/a	n/a	n/a	n/a	n/a
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Beta-3 adrenergic receptor (Human)	BDBM25767 (tert-butyl(2-hydroxy-3-{[4-(morpholin-4-yl)-1,2,5-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	158	n/a	n/a	n/a	n/a	n/a
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Bile salt export pump (Human)	BDBM25767 (tert-butyl(2-hydroxy-3-{[4-(morpholin-4-yl)-1,2,5-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair