Compile Data Set for Download or QSAR

Found 12 hits Enz. Inhib. hit(s) with Target = 'CTP synthase 2'   

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
CTP synthase 2 (Rattus norvegicus)	BDBM50609673 (CHEMBL5267968) Show SMILES CC(C)(C(=O)Nc1ccc(cc1F)-c1cncc(n1)C(F)(F)F)c1csc(NS(=O)(=O)C2CC2)n1 Show InChI	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
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CTP synthase 2 (Homo sapiens)	BDBM50609674 (CHEMBL5283284) Show SMILES CC(C)(C(=O)Nc1ccc(cn1)-c1cncc(n1)C(F)(F)F)c1csc(NS(=O)(=O)C2CC2)n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid PDB UniChem		n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
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CTP synthase 2 (Homo sapiens)	BDBM50609673 (CHEMBL5267968) Show SMILES CC(C)(C(=O)Nc1ccc(cc1F)-c1cncc(n1)C(F)(F)F)c1csc(NS(=O)(=O)C2CC2)n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
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CTP synthase 2 (Rattus norvegicus)	BDBM50609674 (CHEMBL5283284) Show SMILES CC(C)(C(=O)Nc1ccc(cn1)-c1cncc(n1)C(F)(F)F)c1csc(NS(=O)(=O)C2CC2)n1 Show InChI	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem		n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
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CTP synthase 2 (Mus musculus)	BDBM50609673 (CHEMBL5267968) Show SMILES CC(C)(C(=O)Nc1ccc(cc1F)-c1cncc(n1)C(F)(F)F)c1csc(NS(=O)(=O)C2CC2)n1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
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CTP synthase 2 (Mus musculus)	BDBM50609674 (CHEMBL5283284) Show SMILES CC(C)(C(=O)Nc1ccc(cn1)-c1cncc(n1)C(F)(F)F)c1csc(NS(=O)(=O)C2CC2)n1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem		n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
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CTP synthase 2 (Rattus norvegicus)	BDBM50609670 (CHEMBL5277468) Show SMILES CC(C)(C(=O)Nc1ccc(cc1)-c1cccnc1)c1csc(NS(=O)(=O)C2CC2)n1 Show InChI	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
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CTP synthase 2 (Mus musculus)	BDBM50609670 (CHEMBL5277468) Show SMILES CC(C)(C(=O)Nc1ccc(cc1)-c1cccnc1)c1csc(NS(=O)(=O)C2CC2)n1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
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CTP synthase 2 (Rattus norvegicus)	BDBM50609669 (CHEMBL5288393) Show SMILES CCCOc1ccc(NC(=O)C(C)(C)c2csc(NS(=O)(=O)C3CC3)n2)cc1 Show InChI	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	235	n/a	n/a	n/a	n/a	n/a	n/a
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CTP synthase 2 (Homo sapiens)	BDBM50609670 (CHEMBL5277468) Show SMILES CC(C)(C(=O)Nc1ccc(cc1)-c1cccnc1)c1csc(NS(=O)(=O)C2CC2)n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	242	n/a	n/a	n/a	n/a	n/a	n/a
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CTP synthase 2 (Homo sapiens)	BDBM50609669 (CHEMBL5288393) Show SMILES CCCOc1ccc(NC(=O)C(C)(C)c2csc(NS(=O)(=O)C3CC3)n2)cc1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
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CTP synthase 2 (Mus musculus)	BDBM50609669 (CHEMBL5288393) Show SMILES CCCOc1ccc(NC(=O)C(C)(C)c2csc(NS(=O)(=O)C3CC3)n2)cc1 Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt 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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