BDBM50239401 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine::CHEMBL256777::MERCK-544

SMILES: C1C2CC3CC1CC(C2)(C3)c1nnc2CCCCCn12

InChI Key:

Data: 20 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 20 hits for monomerid = 50239401   

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
11-beta-hydroxysteroid dehydrogenase 1 (Mouse)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	97	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase type 2 (Mouse)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase type 2 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Mouse)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	97	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase type 2 (Mouse)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase type 2 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Mouse)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	98	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase type 2 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
17-beta-hydroxysteroid dehydrogenase type 2 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
17-beta-hydroxysteroid dehydrogenase type 1 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase type 2 (Mouse)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase type 2 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Mouse)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	98	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Mouse)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Human)	BDBM50239401 (MERCK-544 | 3-Adamantan-1-yl-6,7,8,9-tetrahydro-5H...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair