Compile Data Set for Download or QSAR

Found 699 hits of ic50 for UniProtKB: P22413   

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 1 (Homo sapiens (Human))	BDBM595471 (US11591313, Compound 039 | US11591313, Compound 03...) Show SMILES COc1cc2ncc(C#N)c(N3CCCC(CNS(N)(=O)=O)CC3)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.220	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595472 (US11591313, Compound 039-E1 | US11591313, Compound...) Show SMILES COc1cc2ncc(C#N)c(N3CCC[C@@H](CNS(N)(=O)=O)CC3)c2cc1OC |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595471 (US11591313, Compound 039 | US11591313, Compound 03...) Show SMILES COc1cc2ncc(C#N)c(N3CCCC(CNS(N)(=O)=O)CC3)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.870	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595468 (US11591313, Compound 038 | US11591313, Compound 03...) Show SMILES COc1cc2ncc(C#N)c(N3CCC[C@H](CCNS(N)(=O)=O)CC3)c2cc1OC |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.940	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595463 (US11591313, Compound 029) Show SMILES COc1cc2ncnc(N3CCN(CC(F)(F)C3)S(N)(=O)=O)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.21	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595482 (US11591313, Compound 049) Show SMILES COc1cc2ncnc(N3CCCC(CCNS(N)(=O)=O)CC3)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.79	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595486 (US11591313, Compound 058) Show SMILES COc1cc2ncnc(\C=C\CCCC#N)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.06	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595417 (US11591313, Compound 053) Show SMILES COc1cc2ncnc(OCCCCNS(N)(=O)=O)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.60	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM50609365 (CHEMBL5282123) Show SMILES Cl.CN1Cc2c(NC1=O)ncnc2N1CCC(C)(CNS(N)(=O)=O)CC1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	3.70	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595478 (US11591313, Compound 043) Show SMILES COc1cc2ncnc(N3CCCC(CC3)NS(N)(=O)=O)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.92	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595457 (US11591313, Compound 018) Show SMILES COc1cc2c(ncnc2cc1OCC(N)=O)N1CCCNCC1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.23	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595487 (US11591313, Compound 060) Show SMILES COc1cc2ncnc(N3CCCC(CNS(N)(=O)=O)CC3)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.34	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595449 (US11591313, Compound 007) Show SMILES COc1cc2ncc(C#N)c(NCCCCNS(N)=O)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.37	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595464 (US11591313, Compound 032) Show SMILES COc1cc2ncc(C#N)c(N3CCCN(CCN4C(=O)c5ccccc5C4=O)CC3)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595468 (US11591313, Compound 038 | US11591313, Compound 03...) Show SMILES COc1cc2ncc(C#N)c(N3CCC[C@H](CCNS(N)(=O)=O)CC3)c2cc1OC |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.95	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595456 (US11591313, Compound 015 | US11591313, Compound 01...) Show SMILES COc1cc2ncnc(N3CCCN(CC3)S(N)(=O)=O)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	US Patent	n/a	n/a	5.97	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595456 (US11591313, Compound 015 | US11591313, Compound 01...) Show SMILES COc1cc2ncnc(N3CCCN(CC3)S(N)(=O)=O)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	US Patent	n/a	n/a	6.38	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595431 (US11591313, Compound 056) Show SMILES COc1cc2ncnc(NCCCCNS(N)(=O)=O)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.87	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595490 (US11591313, Compound 065) Show SMILES COc1cc2ncnc(N3CCCN(CC3)C(=O)CNS(N)(=O)=O)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.74	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595454 (US11591313, Compound 008) Show SMILES COc1cc2ncc(C#N)c(NCCCCCNS(N)(=O)=O)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.11	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM595479 (US11591313, Compound 046) Show SMILES COc1cc2ncc(C#N)c(-c3ccc(CNS(=O)(=O)NC(=O)OC(C)(C)C)nc3)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Table 1: Assay Buffer: 1 mM CaCl2, 0.2 mM ZnCl2, 50 mM Tris, pH 9.0 Substrate: 1.5 mM Thymidine 5′-monophosphate disodium salt hydrate (Sigma: ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92G7S
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624579 (US11780849, Compound 150 | {2-[1-(6-fluoro-7-metho...) Show SMILES COc1cc2nccc(N3CCC(CCS(C)(=N)=O)CC3)c2cc1F Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624580 (US11780849, Compound 151 | {2-[1-(6,7-dimethoxycin...) Show SMILES COc1cc2nncc(N3CCC(CCS(C)(=N)=O)CC3)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624581 (6-chloro-4-(4-{2-[imino(methyl)oxo-lambda6- sulfan...) Show SMILES COc1cc2ncc(C#N)c(N3CCC(CCS(C)(=N)=O)CC3)c2cc1Cl Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624592 (US11780849, Compound 161 | [7-(6,7-dimethoxyquinol...) Show SMILES COc1cc2nccc(-c3ccc4CCN(Cc4c3)S(C)(=N)=O)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624479 ((2-(1-(6,7-dimethoxyquinazolin-4-yl)piperidin- 4-y...) Show SMILES COc1cc2ncnc(N3CCC(CCS(C)(=N)=O)CC3)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624486 (6,7-dimethoxy-4-(2-(S-methylsulfonimidoyl)- 1,2,3,...) Show SMILES COc1cc2ncnc(-c3ccc4CCN(Cc4c3)S(C)(=N)=O)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624489 (6-fluoro-7-methoxy-4-(4-(2-(S- methylsulfonimidoyl...) Show SMILES COc1cc2ncc(C#N)c(N3CCC(CCS(C)(=N)=O)CC3)c2cc1F Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624499 (8-(6,7-dimethoxyquinazolin-4-yl)-2-(S- methylsulfo...) Show SMILES COc1cc2ncnc(N3CCC4(CCN(C4)S(C)(=N)=O)CC3)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624500 (US11780849, Compound 54a) Show SMILES COc1cc2ncnc(N3CCC4(CCN(C4)[S@@](C)(=N)=O)CC3)c2cc1OC |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624501 (US11780849, Compound 54b) Show SMILES COc1cc2ncnc(N3CCC4(CCN(C4)[S@](C)(=N)=O)CC3)c2cc1OC |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624502 (8-(7-methoxyquinolin-4-yl)-2-(S- methylsulfonimido...) Show SMILES COc1ccc2c(ccnc2c1)N1CCC2(CCN(C2)S(C)(=N)=O)CC1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624503 (US11780849, Compound 55a) Show SMILES COc1ccc2c(ccnc2c1)N1CCC2(CCN(C2)[S@](C)(=N)=O)CC1 |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624507 (US11780849, Compound 60 | cyclopropyl(imino)(4-((7...) Show SMILES COc1ccc2c(Oc3ccc(cc3)S(=N)(=O)C3CC3)ccnc2c1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624508 (US11780849, Compound 60a) Show SMILES COc1ccc2c(Oc3ccc(cc3)[S@@](=N)(=O)C3CC3)ccnc2c1 |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624513 (US11780849, Compound 75 | imino(4-(((7-methoxyquin...) Show SMILES COc1ccc2c(OCc3ccc(cc3)S(C)(=N)=O)ccnc2c1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624514 (US11780849, Compound 75a) Show SMILES COc1ccc2c(OCc3ccc(cc3)[S@@](C)(=N)=O)ccnc2c1 |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624520 (US11780849, Compound 80 | imino(4-((7-methoxyquino...) Show SMILES COc1ccc2c(Oc3ccc(cc3)S(C)(=N)=O)ccnc2c1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624521 (US11780849, Compound 80a) Show SMILES COc1ccc2c(Oc3ccc(cc3)[S@@](C)(=N)=O)ccnc2c1 |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624525 (N-((1-(6,7-dimethoxyquinazolin-4- yl)piperidin-4- ...) Show SMILES COc1cc2ncnc(N3CCC(CNS(C)(=N)=O)CC3)c2cc1OC Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624530 (US11780849, Compound 103 | ethyl(imino)(4-((7-meth...) Show SMILES CCS(=N)(=O)c1ccc(Oc2ccnc3cc(OC)ccc23)cc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624532 (US11780849, Compound 103b) Show SMILES CC[S@](=N)(=O)c1ccc(Oc2ccnc3cc(OC)ccc23)cc1 |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624533 (US11780849, Compound 114 | {4-[(6-fluoro-7-methoxy...) Show SMILES COc1cc2nccc(Oc3ccc(cc3)S(C)(=N)=O)c2cc1F Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624534 (US11780849, Compound 114a) Show SMILES COc1cc2nccc(Oc3ccc(cc3)[S@](C)(=N)=O)c2cc1F |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624541 (US11780849, Compound 120 | [cyclopropyl({4-[(6-flu...) Show SMILES COc1cc2nccc(Oc3ccc(cc3)S(=N)(=O)C3CC3)c2cc1F Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624542 (US11780849, Compound 120a) Show SMILES COc1cc2nccc(Oc3ccc(cc3)[S@@](=N)(=O)C3CC3)c2cc1F |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624556 (US11780849, Compound 133 | imino(3-{[(7-methoxyqui...) Show SMILES COc1ccc2c(OCc3cccc(c3)S(C)(=N)=O)ccnc2c1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624557 (US11780849, Compound 133a) Show SMILES COc1ccc2c(OCc3cccc(c3)[S@@](C)(=N)=O)ccnc2c1 |r| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624560 ((3-fluoro-4-{[(7-methoxyquinolin-4- yl)oxy]methyl}...) Show SMILES COc1ccc2c(OCc3ccc(cc3F)S(C)(=N)=O)ccnc2c1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (Homo sapiens (Human))	BDBM624561 ((4-{[6-fluoro-7-methoxyquinolin-4- yl)oxy]methyl}p...) Show SMILES COc1cc2nccc(OCc3ccc(cc3)S(C)(=N)=O)c2cc1F Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
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