BDBM82124 adenosine-derived inhibitor (Grp78), 1

SMILES: Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)([O-])=O)[C@@H](O)[C@H]1O

InChI Key: InChIKey=XTWYTFMLZFPYCI-UHFFFAOYSA-M

Data: 1 KI  2 Kd  1 K_off  1 ITC

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 3 hits for monomerid = 82124   

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
Endoplasmic reticulum chaperone BiP (Human)	BDBM82124 (adenosine-derived inhibitor (Grp78), 1) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	2.17E+3	n/a	0.00500	n/a	7.4	25
TBA									Citation and Details
					More data for this Ligand-Target Pair
Heat shock 70 kDa protein 1A (Human)	BDBM82124 (adenosine-derived inhibitor (Grp78), 1) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	500	n/a	n/a	n/a	7.4	25
TBA									Citation and Details
					More data for this Ligand-Target Pair
Heat shock 70 kDa protein 1A (Human)	BDBM82124 (adenosine-derived inhibitor (Grp78), 1) Show SMILES Show InChI	GoogleScholar	UniChem		110	-9.49	n/a	n/a	n/a	n/a	n/a	7.4	25
TBA									Citation and Details
					More data for this Ligand-Target Pair