BDBM32378 adenosine-derived inhibitor (Grp78), 13::adenosine-derived inhibitor, 12

SMILES: Nc1ncnc2n([C@@H]3O[C@H](COCc4ccc(cc4)C#N)[C@@H](O)[C@H]3O)c(NCc3ccc(Cl)c(Cl)c3)nc12

InChI Key: InChIKey=ZXGGCBQORXDVTE-UHFFFAOYSA-N

Data: 5 KI  4 IC50  3 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 12 hits for monomerid = 32378   

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
Heat shock 70 kDa protein 1A (Human)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	500	n/a	n/a	n/a	n/a	7.4	23
TBA									Citation and Details
					More data for this Ligand-Target Pair
Heat shock 70 kDa protein 1A (Human)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	300	n/a	n/a	n/a	7.4	25
TBA									Citation and Details
					More data for this Ligand-Target Pair
Endoplasmic reticulum chaperone BiP (Human)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	80	n/a	0.0900	n/a	7.4	25
TBA									Citation and Details
					More data for this Ligand-Target Pair
Heat shock 70 kDa protein 1A (Human)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	300	n/a	n/a	n/a	7.4	25
TBA									Citation and Details
					More data for this Ligand-Target Pair
Endoplasmic reticulum chaperone BiP (Human)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Transient receptor potential cation channel subfamily M member 7 (Mouse)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Human)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Heat shock 70 kDa protein 1A (Human)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		120	-9.43	n/a	n/a	n/a	n/a	n/a	7.4	25
TBA									Citation and Details
					More data for this Ligand-Target Pair
Heat shock-related 70 kDa protein 2 (Human)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		<200	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
Heat shock-related 70 kDa protein 2 (Human)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		>200	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
Heat shock-related 70 kDa protein 2 (Human)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		<200	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
Heat shock-related 70 kDa protein 2 (Human)	BDBM32378 (adenosine-derived inhibitor (Grp78), 13 | adenosin...) Show SMILES Show InChI	GoogleScholar	UniChem		>200	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