Compile Data Set for Download or QSAR

Found 48 hits Enz. Inhib. hit(s) with all data for entry = 50018801   

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
Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612720 (CHEMBL5279528) Show SMILES CN(CCO)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)c(O)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612719 (CHEMBL5285816) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)c(O)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612714 (CHEMBL5279646) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C2CCCCC2)C1=O)N(C)CCCO Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	990	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612719 (CHEMBL5285816) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)c(O)c1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612711 (CHEMBL5278688) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)c(OC)c1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.17E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612706 (CHEMBL5283659) Show SMILES CN(CCCO)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)cc1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.19E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612709 (CHEMBL5282245) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C1=O)c1ccccc1)N(C)C Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612710 (CHEMBL5290483) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)c(OC)c1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.34E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612720 (CHEMBL5279528) Show SMILES CN(CCO)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)c(O)c1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.44E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612711 (CHEMBL5278688) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)c(OC)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612712 (CHEMBL5269753) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C2CCCCC2)C1=O)N(C)CCO Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612718 (CHEMBL5269857) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)c(O)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.66E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612700 (CHEMBL5287478) Show SMILES CN(C)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)cc1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612712 (CHEMBL5269753) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C2CCCCC2)C1=O)N(C)CCO Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.72E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612703 (CHEMBL5269456) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)cc1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.74E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612701 (CHEMBL5266372) Show SMILES CN(C)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.76E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612704 (CHEMBL5266063) Show SMILES CN(CCO)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612701 (CHEMBL5266372) Show SMILES CN(C)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)cc1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.93E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612710 (CHEMBL5290483) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)c(OC)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.95E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612703 (CHEMBL5269456) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.96E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612709 (CHEMBL5282245) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C1=O)c1ccccc1)N(C)C Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.08E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612714 (CHEMBL5279646) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C2CCCCC2)C1=O)N(C)CCCO Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.17E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612716 (CHEMBL5270712) Show SMILES CN(C)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)c(O)c1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612718 (CHEMBL5269857) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)c(O)c1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612706 (CHEMBL5283659) Show SMILES CN(CCCO)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612704 (CHEMBL5266063) Show SMILES CN(CCO)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)cc1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612715 (CHEMBL5287582) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C1=O)c1ccccc1)N(C)CCCO Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612713 (CHEMBL5271584) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C1=O)c1ccccc1)N(C)CCO Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612722 (CHEMBL5268914) Show SMILES CN(CCCO)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)c(O)c1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612707 (CHEMBL5287636) Show SMILES CN(CCCO)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.72E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612715 (CHEMBL5287582) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C1=O)c1ccccc1)N(C)CCCO Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.79E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612705 (CHEMBL5291222) Show SMILES CN(CCO)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.82E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612713 (CHEMBL5271584) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C1=O)c1ccccc1)N(C)CCO Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.82E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612705 (CHEMBL5291222) Show SMILES CN(CCO)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)cc1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.83E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612716 (CHEMBL5270712) Show SMILES CN(C)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)c(O)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.96E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612707 (CHEMBL5287636) Show SMILES CN(CCCO)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)cc1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	3.39E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612722 (CHEMBL5268914) Show SMILES CN(CCCO)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)c(O)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	3.39E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612717 (CHEMBL5268551) Show SMILES CN(C)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)c(O)c1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	3.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612700 (CHEMBL5287478) Show SMILES CN(C)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	3.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612717 (CHEMBL5268551) Show SMILES CN(C)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)c(O)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	3.73E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612721 (CHEMBL5282886) Show SMILES CN(CCO)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)c(O)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612723 (CHEMBL5286033) Show SMILES CN(CCCO)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)c(O)c1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612721 (CHEMBL5282886) Show SMILES CN(CCO)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)c(O)c1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612702 (CHEMBL5290730) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5.66E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612723 (CHEMBL5286033) Show SMILES CN(CCCO)c1ccc(\C=C2\N(C)C(=S)N(C2=O)c2ccccc2)c(O)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	6.33E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612702 (CHEMBL5290730) Show SMILES CCN(CC)c1ccc(\C=C2\N(C)C(=S)N(C3CCCCC3)C2=O)cc1 Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	6.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
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NADPH oxidase 4 (Homo sapiens (Human))	BDBM50612708 (CHEMBL5277244) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C2CCCCC2)C1=O)N(C)C Show InChI	KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome b-245 heavy chain (Homo sapiens (Human))	BDBM50612708 (CHEMBL5277244) Show SMILES COc1cc(ccc1\C=C1\N(C)C(=S)N(C2CCCCC2)C1=O)N(C)C Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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