BDBM50118223 AR-C67085::Adenosine triphosphate derivative::CHEMBL336292::CHEMBL369928

SMILES: CCCSc1nc(N)c2ncn([C@@H]3O[C@H](COP(O)(=O)OP(O)(=O)C(Cl)(Cl)P(O)(O)=O)[C@@H](O)[C@H]3O)c2n1

InChI Key: InChIKey=ZLIAJZQKKBOFJR-UHFFFAOYSA-N

Data: 2 IC50  1 Kd  2 EC50

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 5 hits for monomerid = 50118223   

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
Bile salt export pump (Human)	BDBM50118223 (CHEMBL336292 | CHEMBL369928 | AR-C67085 | Adenosin...) 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
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2Y purinoceptor 12 (Human)	BDBM50118223 (CHEMBL336292 | CHEMBL369928 | AR-C67085 | Adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	4.57	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2Y purinoceptor 11 (Human)	BDBM50118223 (CHEMBL336292 | CHEMBL369928 | AR-C67085 | Adenosin...) 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 12 (Human)	BDBM50118223 (CHEMBL336292 | CHEMBL369928 | AR-C67085 | Adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.30	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
P2Y purinoceptor 12 (Human)	BDBM50118223 (CHEMBL336292 | CHEMBL369928 | AR-C67085 | Adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair