BDBM50176058 2-Butyl-9-methyl-8-[1,2,3]triazol-2-yl-9H-purin-6-ylamine::2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-yl)-9H-purin-6-amine::CHEMBL197669::ST-1535

SMILES: CCCCc1nc(N)c2nc(-n3nccn3)n(C)c2n1

InChI Key: InChIKey=CYYQMAWUIRPCNW-UHFFFAOYSA-N

Data: 13 KI  1 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 14 hits for monomerid = 50176058   

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
Adenosine receptor A2a (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		6.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		6.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		6.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		6.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		72	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		72	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		79	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A2b (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		352	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A2b (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		352	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Human)	BDBM50176058 (ST-1535 | 2-butyl-9-methyl-8-(2H-1,2,3-triazol-2-y...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair