Compile Data Set for Download or QSAR

Found 92 hits Enz. Inhib. hit(s) with all data for entry = 50015061   

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 kinase JAK1 (Homo sapiens (Human))	BDBM50355501 (INCB-018424 | RUXOLITINIB | RUXOLITINIB PHOSPHATE ...) Show SMILES N#CC[C@H](C1CCCC1)n1cc(cn1)-c1ncnc2[nH]ccc12 |r| Show InChI InChI=1S/C17H18N6/c18-7-5-15(12-3-1-2-4-12)23-10-13(9-22-23)16-14-6-8-19-17(14)21-11-20-16/h6,8-12,15H,1-5H2,(H,19,20,21)/t15-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK1 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50355501 (INCB-018424 | RUXOLITINIB | RUXOLITINIB PHOSPHATE ...) Show SMILES N#CC[C@H](C1CCCC1)n1cc(cn1)-c1ncnc2[nH]ccc12 |r| Show InChI InChI=1S/C17H18N6/c18-7-5-15(12-3-1-2-4-12)23-10-13(9-22-23)16-14-6-8-19-17(14)21-11-20-16/h6,8-12,15H,1-5H2,(H,19,20,21)/t15-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	2.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair				3D Structure (crystal)
Non-receptor tyrosine-protein kinase TYK2 (Homo sapiens (Human))	BDBM50582343 (CHEMBL5092781) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TYK2 (unknown origin) incubated for 40 min in presence of ATP by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Polyamine deacetylase HDAC10 (Homo sapiens (Human))	BDBM50582354 (CHEMBL5076728) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.60	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant HDAC10 (unknown origin) using Ac-peptide-AMC as substrate incubated for 240 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM50582354 (CHEMBL5076728) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC3 (unknown origin) incubated for 60 mins using microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582343 (CHEMBL5092781) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582346 (CHEMBL5079785) Show SMILES CS(=O)(=O)c1ccc(cc1)-n1ccc2cnc(Nc3cnn(CCCCCCC(=O)NO)c3)nc12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.90	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582354 (CHEMBL5076728) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM50582343 (CHEMBL5092781) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK1 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50582354 (CHEMBL5076728) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant HDAC8 (unknown origin) using Ac-peptide-AMC as substrate incubated for 240 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582344 (CHEMBL5093377) Show SMILES CS(=O)(=O)c1ccc(cc1)-n1ccc2cnc(Nc3cnn(CCCCCC(=O)NO)c3)nc12 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582345 (CHEMBL5083330) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Homo sapiens (Human))	BDBM50355501 (INCB-018424 | RUXOLITINIB | RUXOLITINIB PHOSPHATE ...) Show SMILES N#CC[C@H](C1CCCC1)n1cc(cn1)-c1ncnc2[nH]ccc12 |r| Show InChI InChI=1S/C17H18N6/c18-7-5-15(12-3-1-2-4-12)23-10-13(9-22-23)16-14-6-8-19-17(14)21-11-20-16/h6,8-12,15H,1-5H2,(H,19,20,21)/t15-/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TYK2 (unknown origin) incubated for 40 min in presence of ATP by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582344 (CHEMBL5093377) Show SMILES CS(=O)(=O)c1ccc(cc1)-n1ccc2cnc(Nc3cnn(CCCCCC(=O)NO)c3)nc12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582349 (CHEMBL5093859) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(-c4ccc(Br)cc4)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582358 (CHEMBL5078586) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582348 (CHEMBL5081471) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(-c4ccccc4)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Homo sapiens (Human))	BDBM50582345 (CHEMBL5083330) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TYK2 (unknown origin) incubated for 40 min in presence of ATP by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM50582343 (CHEMBL5092781) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK3 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582355 (CHEMBL5078697) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582343 (CHEMBL5092781) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582347 (CHEMBL5087239) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582345 (CHEMBL5083330) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582372 (CHEMBL5075022) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(CC4CC4)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM50582347 (CHEMBL5087239) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK3 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582346 (CHEMBL5079785) Show SMILES CS(=O)(=O)c1ccc(cc1)-n1ccc2cnc(Nc3cnn(CCCCCCC(=O)NO)c3)nc12 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582347 (CHEMBL5087239) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582348 (CHEMBL5081471) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(-c4ccccc4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582350 (CHEMBL5093906) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4cccc(Cl)c4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM50582345 (CHEMBL5083330) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK3 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582349 (CHEMBL5093859) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(-c4ccc(Br)cc4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM50582347 (CHEMBL5087239) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK1 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582359 (CHEMBL5083776) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(-c4ccc(Br)cc4)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM50582348 (CHEMBL5081471) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(-c4ccccc4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK1 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM50355501 (INCB-018424 | RUXOLITINIB | RUXOLITINIB PHOSPHATE ...) Show SMILES N#CC[C@H](C1CCCC1)n1cc(cn1)-c1ncnc2[nH]ccc12 |r| Show InChI InChI=1S/C17H18N6/c18-7-5-15(12-3-1-2-4-12)23-10-13(9-22-23)16-14-6-8-19-17(14)21-11-20-16/h6,8-12,15H,1-5H2,(H,19,20,21)/t15-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK3 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582353 (CHEMBL5091553) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(-c4ccc(F)cc4)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582371 (CHEMBL5089674) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(C4CCCC4)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Homo sapiens (Human))	BDBM50582347 (CHEMBL5087239) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TYK2 (unknown origin) incubated for 40 min in presence of ATP by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Homo sapiens (Human))	BDBM50582348 (CHEMBL5081471) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(-c4ccccc4)c3n2)cn1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of TYK2 (unknown origin) incubated for 40 min in presence of ATP by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582351 (CHEMBL5070551) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4Cl)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM50582354 (CHEMBL5076728) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK3 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM19149 (CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC3 (unknown origin) incubated for 60 mins using microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582374 (CHEMBL5077078) Show SMILES COc1cccc(Cn2ccc3cnc(Nc4cnn(CCCCCCC(=O)NO)c4)nc23)c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582352 (CHEMBL5092838) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4Cl)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM50582345 (CHEMBL5083330) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK1 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50582357 (CHEMBL5076046) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(-c4ccc(Cl)cc4)c3n2)cn1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of HDAC6 (unknown origin) incubated for 60 mins by microplate reader analysis				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM50582354 (CHEMBL5076728) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK1 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582353 (CHEMBL5091553) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(-c4ccc(F)cc4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582354 (CHEMBL5076728) Show SMILES ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50582355 (CHEMBL5078697) Show SMILES ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4)c3n2)cn1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of JAK2 (unknown origin) preincubated for 60 mins followed by reagent A addition and measured after 60 mins in presence of ATP by using mi...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c02111 BindingDB Entry DOI: 10.7270/Q26M3BQC
					More data for this Ligand-Target Pair

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