null

SMILES: CN1CCN(Cc2nn(CC(=O)N3CCc4[nH]nnc4C3)cc2-c2cnc(NC3Cc4ccccc4C3)nc2)CC1=O

InChI Key: InChIKey=DCVGCQPXTOSWEA-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 489380   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 (Homo sapiens (Human))	BDBM489380 (Example 12-8 | US10961242, Compound 87 | US1154888...) Show SMILES CN1CCN(Cc2nn(CC(=O)N3CCc4[nH]nnc4C3)cc2-c2cnc(NC3Cc4ccccc4C3)nc2)CC1=O Show InChI InChI=1S/C29H33N11O2/c1-37-8-9-38(17-27(37)41)15-25-23(14-40(35-25)18-28(42)39-7-6-24-26(16-39)34-36-33-24)21-12-30-29(31-13-21)32-22-10-19-4-2-3-5-20(19)11-22/h2-5,12-14,22H,6-11,15-18H2,1H3,(H,30,31,32)(H,33,34,36)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Two-fold dilution of each test compound solution (10 μM, 100% dimethyl sulfoxide) is carried out on 96-well V bottom plate (Costar 3363). After ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2F76HDX
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 (Homo sapiens (Human))	BDBM489380 (Example 12-8 | US10961242, Compound 87 | US1154888...) Show SMILES CN1CCN(Cc2nn(CC(=O)N3CCc4[nH]nnc4C3)cc2-c2cnc(NC3Cc4ccccc4C3)nc2)CC1=O Show InChI InChI=1S/C29H33N11O2/c1-37-8-9-38(17-27(37)41)15-25-23(14-40(35-25)18-28(42)39-7-6-24-26(16-39)34-36-33-24)21-12-30-29(31-13-21)32-22-10-19-4-2-3-5-20(19)11-22/h2-5,12-14,22H,6-11,15-18H2,1H3,(H,30,31,32)(H,33,34,36)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
LegoChem Biosciences, Inc. US Patent					Assay Description Two-fold dilution of each test compound solution (10 μM, 100% dimethyl sulfoxide) is carried out on 96-well V bottom plate (Costar 3363). After ...				US Patent US10961242 (2021) BindingDB Entry DOI: 10.7270/Q27084JN
					More data for this Ligand-Target Pair