Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein phosphatase non-receptor type 11' and Ligand = 'BDBM479360'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Tyrosine-protein phosphatase non-receptor type 11 (Homo sapiens (Human))	BDBM479360 ((3-((3S,4S)-4-amino-3-methyl-2-oxa- 8-azaspiro[4.5...) Show SMILES COCOC[C@H]1C[C@H]2COc3c(Sc4nc(CO)c(nc4C)N4CCC5(CO[C@@H](C)[C@H]5N)CC4)ccnc3N2C1 |r| Show InChI InChI=1S/C28H40N6O5S/c1-17-27(32-21(12-35)25(31-17)33-8-5-28(6-9-33)15-39-18(2)24(28)29)40-22-4-7-30-26-23(22)38-14-20-10-19(11-34(20)26)13-37-16-36-3/h4,7,18-20,24,35H,5-6,8-16,29H2,1-3H3/t18-,19-,20-,24+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The phosphatase reactions were carried out at room temperature in 384-well black polystyrene plates (Greiner Bio-One, Cat #784076) using assay buffer...				Citation and Details BindingDB Entry DOI: 10.7270/Q2SX6J2V
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 11 (Homo sapiens (Human))	BDBM479360 ((3-((3S,4S)-4-amino-3-methyl-2-oxa- 8-azaspiro[4.5...) Show SMILES COCOC[C@H]1C[C@H]2COc3c(Sc4nc(CO)c(nc4C)N4CCC5(CO[C@@H](C)[C@H]5N)CC4)ccnc3N2C1 |r| Show InChI InChI=1S/C28H40N6O5S/c1-17-27(32-21(12-35)25(31-17)33-8-5-28(6-9-33)15-39-18(2)24(28)29)40-22-4-7-30-26-23(22)38-14-20-10-19(11-34(20)26)13-37-16-36-3/h4,7,18-20,24,35H,5-6,8-16,29H2,1-3H3/t18-,19-,20-,24+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Nikang Therapeutics, Inc. US Patent					Assay Description SHP2 possesses two N-terminal Src homology 2 (SH2) domains, a central protein-tyrosine phosphatase (PTP) domain, and C-terminal tail. At the basal st...				US Patent US10894797 (2021) BindingDB Entry DOI: 10.7270/Q2222XV2
					More data for this Ligand-Target Pair