BDBM50118232 2-MeSATP::ATP, 2-meS::CHEMBL336208

SMILES: CSc1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)N

InChI Key: InChIKey=XNOBOKJVOTYSJV-UHFFFAOYSA-N

Data: 4 KI  17 EC50

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 22 hits for monomerid = 50118232   

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
P2Y purinoceptor 6 (Human)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2X purinoceptor 4 (Human)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2X purinoceptor 4 (Rat)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2X purinoceptor 4 (Mouse)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2Y purinoceptor 1 (Rat)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2X purinoceptor 5 (Rat)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2X purinoceptor 4 (Human)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2X purinoceptor 1 (Human)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	54	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2Y purinoceptor 12 (Rat)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.10	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2X purinoceptor 4 (Rat)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	7.40E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2X purinoceptor 6 (Rat)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	600	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2X purinoceptor 2 (Rat)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2Y purinoceptor 11 (Human)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2X purinoceptor 3 (Human)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	350	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2Y purinoceptor 1 (Wild turkey)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	8	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2Y purinoceptor 1 (Human)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	34	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2Y purinoceptor 1 (Wild turkey)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	8	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2X purinoceptor 2 (Human)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		2.20	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
P2X purinoceptor 3 (Human)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		8.20	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
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Human)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		5.00E+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
S-adenosylmethionine synthase isoform type-1/type-2 (Rat)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		1.10E+5	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
S-adenosylmethionine synthase isoform type-2 (Rat)	BDBM50118232 (ATP, 2-meS | CHEMBL336208 | 2-MeSATP) Show SMILES Show InChI	GoogleScholar	UniChem		6.00E+5	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