Compile Data Set for Download or QSAR

Found 110 hits Enz. Inhib. hit(s) with all data for entry = 50038147   

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
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372229 (CHEMBL428248) Show SMILES CC(C)N(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C16H22ClN3/c1-12(2)20(16-5-7-19-8-6-16)11-14-9-15(17)4-3-13(14)10-18/h3-4,9,12,16,19H,5-8,11H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372207 (CHEMBL272708) Show SMILES CN(Cc1cc(Cl)ccc1[N+]([O-])=O)C1CCN(C)CC1 Show InChI InChI=1S/C14H20ClN3O2/c1-16-7-5-13(6-8-16)17(2)10-11-9-12(15)3-4-14(11)18(19)20/h3-4,9,13H,5-8,10H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372207 (CHEMBL272708) Show SMILES CN(Cc1cc(Cl)ccc1[N+]([O-])=O)C1CCN(C)CC1 Show InChI InChI=1S/C14H20ClN3O2/c1-16-7-5-13(6-8-16)17(2)10-11-9-12(15)3-4-14(11)18(19)20/h3-4,9,13H,5-8,10H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372222 (CHEMBL403952) Show SMILES CCN(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C15H20ClN3/c1-2-19(15-5-7-18-8-6-15)11-13-9-14(16)4-3-12(13)10-17/h3-4,9,15,18H,2,5-8,11H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372213 (CHEMBL256378) Show SMILES CCCN(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C16H22ClN3/c1-2-9-20(16-5-7-19-8-6-16)12-14-10-15(17)4-3-13(14)11-18/h3-4,10,16,19H,2,5-9,12H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372213 (CHEMBL256378) Show SMILES CCCN(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C16H22ClN3/c1-2-9-20(16-5-7-19-8-6-16)12-14-10-15(17)4-3-13(14)11-18/h3-4,10,16,19H,2,5-9,12H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372223 (CHEMBL428069) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCN(CCc2ccccc2)CC1 Show InChI InChI=1S/C22H26ClN3/c1-25(17-20-15-21(23)8-7-19(20)16-24)22-10-13-26(14-11-22)12-9-18-5-3-2-4-6-18/h2-8,15,22H,9-14,17H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372210 (CHEMBL256618) Show SMILES Clc1ccc(C#N)c(CN(CC2CC2)C2CCNCC2)c1 Show InChI InChI=1S/C17H22ClN3/c18-16-4-3-14(10-19)15(9-16)12-21(11-13-1-2-13)17-5-7-20-8-6-17/h3-4,9,13,17,20H,1-2,5-8,11-12H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50124535 (1-(6-CYANO-3-PYRIDYLCARBONYL)-5',8'-DIFLUOROSPIRO[...) Show SMILES NC1=NC2(CCN(CC2)C(=O)c2ccc(nc2)C#N)Nc2c(F)ccc(F)c12 |t:1| Show InChI InChI=1S/C19H16F2N6O/c20-13-3-4-14(21)16-15(13)17(23)26-19(25-16)5-7-27(8-6-19)18(28)11-1-2-12(9-22)24-10-11/h1-4,10,25H,5-8H2,(H2,23,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair				3D Structure (crystal)
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372212 (CHEMBL271248) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCCNC1 |w:12.12| Show InChI InChI=1S/C14H18ClN3/c1-18(14-3-2-6-17-9-14)10-12-7-13(15)5-4-11(12)8-16/h4-5,7,14,17H,2-3,6,9-10H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50372207 (CHEMBL272708) Show SMILES CN(Cc1cc(Cl)ccc1[N+]([O-])=O)C1CCN(C)CC1 Show InChI InChI=1S/C14H20ClN3O2/c1-16-7-5-13(6-8-16)17(2)10-11-9-12(15)3-4-14(11)18(19)20/h3-4,9,13H,5-8,10H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human eNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372212 (CHEMBL271248) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCCNC1 |w:12.12| Show InChI InChI=1S/C14H18ClN3/c1-18(14-3-2-6-17-9-14)10-12-7-13(15)5-4-11(12)8-16/h4-5,7,14,17H,2-3,6,9-10H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372229 (CHEMBL428248) Show SMILES CC(C)N(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C16H22ClN3/c1-12(2)20(16-5-7-19-8-6-16)11-14-9-15(17)4-3-13(14)10-18/h3-4,9,12,16,19H,5-8,11H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50124535 (1-(6-CYANO-3-PYRIDYLCARBONYL)-5',8'-DIFLUOROSPIRO[...) Show SMILES NC1=NC2(CCN(CC2)C(=O)c2ccc(nc2)C#N)Nc2c(F)ccc(F)c12 |t:1| Show InChI InChI=1S/C19H16F2N6O/c20-13-3-4-14(21)16-15(13)17(23)26-19(25-16)5-7-27(8-6-19)18(28)11-1-2-12(9-22)24-10-11/h1-4,10,25H,5-8H2,(H2,23,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of cytokine-induced iNOS activity in human DLD1 cells after 24 hrs				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair				3D Structure (crystal)
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372233 (CHEMBL436643) Show SMILES CN(Cc1cc(Br)ccc1C#N)C1CCN(C)CC1 Show InChI InChI=1S/C15H20BrN3/c1-18-7-5-15(6-8-18)19(2)11-13-9-14(16)4-3-12(13)10-17/h3-4,9,15H,5-8,11H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50086461 ((R)-3-(2-acetimidoylamino-ethylsulfanyl)-2-amino-p...) Show SMILES CC(=N)NCCSC[C@H](N)C(O)=O Show InChI InChI=1S/C7H15N3O2S/c1-5(8)10-2-3-13-4-6(9)7(11)12/h6H,2-4,9H2,1H3,(H2,8,10)(H,11,12)/t6-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50372223 (CHEMBL428069) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCN(CCc2ccccc2)CC1 Show InChI InChI=1S/C22H26ClN3/c1-25(17-20-15-21(23)8-7-19(20)16-24)22-10-13-26(14-11-22)12-9-18-5-3-2-4-6-18/h2-8,15,22H,9-14,17H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human eNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372214 (CHEMBL256620) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCN(CC2CC2)CC1 Show InChI InChI=1S/C18H24ClN3/c1-21(13-16-10-17(19)5-4-15(16)11-20)18-6-8-22(9-7-18)12-14-2-3-14/h4-5,10,14,18H,2-3,6-9,12-13H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372208 (CHEMBL255599) Show SMILES CC(C)CN(Cc1cc(Cl)ccc1C#N)[C@@H]1CCCNC1 Show InChI InChI=1S/C17H24ClN3/c1-13(2)11-21(17-4-3-7-20-10-17)12-15-8-16(18)6-5-14(15)9-19/h5-6,8,13,17,20H,3-4,7,10-12H2,1-2H3/t17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372219 (CHEMBL257007) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCN(Cc2ccccc2)CC1 Show InChI InChI=1S/C21H24ClN3/c1-24(16-19-13-20(22)8-7-18(19)14-23)21-9-11-25(12-10-21)15-17-5-3-2-4-6-17/h2-8,13,21H,9-12,15-16H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372213 (CHEMBL256378) Show SMILES CCCN(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C16H22ClN3/c1-2-9-20(16-5-7-19-8-6-16)12-14-10-15(17)4-3-13(14)11-18/h3-4,10,16,19H,2,5-9,12H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of cytokine-induced iNOS activity in human DLD1 cells after 24 hrs				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50063300 ((L-N6-1-iminoethyl)lysine | (S)-6-Acetimidoylamino...) Show SMILES CC(N)=NCCCC[C@H](N)C(O)=O |r,w:3.3| Show InChI InChI=1S/C8H17N3O2/c1-6(9)11-5-3-2-4-7(10)8(12)13/h7H,2-5,10H2,1H3,(H2,9,11)(H,12,13)/t7-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372208 (CHEMBL255599) Show SMILES CC(C)CN(Cc1cc(Cl)ccc1C#N)[C@@H]1CCCNC1 Show InChI InChI=1S/C17H24ClN3/c1-13(2)11-21(17-4-3-7-20-10-17)12-15-8-16(18)6-5-14(15)9-19/h5-6,8,13,17,20H,3-4,7,10-12H2,1-2H3/t17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372209 (CHEMBL256249) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCN(C)CC1 Show InChI InChI=1S/C15H20ClN3/c1-18-7-5-15(6-8-18)19(2)11-13-9-14(16)4-3-12(13)10-17/h3-4,9,15H,5-8,11H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372223 (CHEMBL428069) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCN(CCc2ccccc2)CC1 Show InChI InChI=1S/C22H26ClN3/c1-25(17-20-15-21(23)8-7-19(20)16-24)22-10-13-26(14-11-22)12-9-18-5-3-2-4-6-18/h2-8,15,22H,9-14,17H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372211 (CHEMBL256414) Show SMILES CC(C)CN(Cc1cc(Cl)ccc1C#N)[C@H]1CCCN(C)C1 Show InChI InChI=1S/C18H26ClN3/c1-14(2)11-22(18-5-4-8-21(3)13-18)12-16-9-17(19)7-6-15(16)10-20/h6-7,9,14,18H,4-5,8,11-13H2,1-3H3/t18-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of cytokine-induced iNOS activity in human DLD1 cells after 24 hrs				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372226 (CHEMBL256415) Show SMILES CC(C)CN(Cc1cc(Cl)ccc1C#N)[C@H]1CCCNC1 Show InChI InChI=1S/C17H24ClN3/c1-13(2)11-21(17-4-3-7-20-10-17)12-15-8-16(18)6-5-14(15)9-19/h5-6,8,13,17,20H,3-4,7,10-12H2,1-2H3/t17-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372231 (CHEMBL272697) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C14H18ClN3/c1-18(14-4-6-17-7-5-14)10-12-8-13(15)3-2-11(12)9-16/h2-3,8,14,17H,4-7,10H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372220 (CHEMBL257008) Show SMILES CCCCN1CCC(CC1)N(C)Cc1cc(Cl)ccc1C#N Show InChI InChI=1S/C18H26ClN3/c1-3-4-9-22-10-7-18(8-11-22)21(2)14-16-12-17(19)6-5-15(16)13-20/h5-6,12,18H,3-4,7-11,14H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372231 (CHEMBL272697) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C14H18ClN3/c1-18(14-4-6-17-7-5-14)10-12-8-13(15)3-2-11(12)9-16/h2-3,8,14,17H,4-7,10H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372222 (CHEMBL403952) Show SMILES CCN(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C15H20ClN3/c1-2-19(15-5-7-18-8-6-15)11-13-9-14(16)4-3-12(13)10-17/h3-4,9,15,18H,2,5-8,11H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372230 (CHEMBL258310) Show SMILES CCN1CCC(CC1)N(C)Cc1cc(Cl)ccc1C#N Show InChI InChI=1S/C16H22ClN3/c1-3-20-8-6-16(7-9-20)19(2)12-14-10-15(17)5-4-13(14)11-18/h4-5,10,16H,3,6-9,12H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372230 (CHEMBL258310) Show SMILES CCN1CCC(CC1)N(C)Cc1cc(Cl)ccc1C#N Show InChI InChI=1S/C16H22ClN3/c1-3-20-8-6-16(7-9-20)19(2)12-14-10-15(17)5-4-13(14)11-18/h4-5,10,16H,3,6-9,12H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372229 (CHEMBL428248) Show SMILES CC(C)N(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C16H22ClN3/c1-12(2)20(16-5-7-19-8-6-16)11-14-9-15(17)4-3-13(14)10-18/h3-4,9,12,16,19H,5-8,11H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of cytokine-induced iNOS activity in human DLD1 cells after 24 hrs				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372228 (CHEMBL402217) Show SMILES CC(C)CN(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C17H24ClN3/c1-13(2)11-21(17-5-7-20-8-6-17)12-15-9-16(18)4-3-14(15)10-19/h3-4,9,13,17,20H,5-8,11-12H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372224 (CHEMBL402425) Show SMILES CC(C)CCN1CCC(CC1)N(C)Cc1cc(Cl)ccc1C#N Show InChI InChI=1S/C19H28ClN3/c1-15(2)6-9-23-10-7-19(8-11-23)22(3)14-17-12-18(20)5-4-16(17)13-21/h4-5,12,15,19H,6-11,14H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372220 (CHEMBL257008) Show SMILES CCCCN1CCC(CC1)N(C)Cc1cc(Cl)ccc1C#N Show InChI InChI=1S/C18H26ClN3/c1-3-4-9-22-10-7-18(8-11-22)21(2)14-16-12-17(19)6-5-15(16)13-20/h5-6,12,18H,3-4,7-11,14H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372232 (CHEMBL256069) Show SMILES CN(Cc1cc(Cl)ccc1Br)C1CCN(C)CC1 Show InChI InChI=1S/C14H20BrClN2/c1-17-7-5-13(6-8-17)18(2)10-11-9-12(16)3-4-14(11)15/h3-4,9,13H,5-8,10H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50372230 (CHEMBL258310) Show SMILES CCN1CCC(CC1)N(C)Cc1cc(Cl)ccc1C#N Show InChI InChI=1S/C16H22ClN3/c1-3-20-8-6-16(7-9-20)19(2)12-14-10-15(17)5-4-13(14)11-18/h4-5,10,16H,3,6-9,12H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human eNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372225 (CHEMBL256402) Show SMILES CC(C)CN(Cc1cc(Cl)ccc1C#N)[C@@H]1CCCN(C)C1 Show InChI InChI=1S/C18H26ClN3/c1-14(2)11-22(18-5-4-8-21(3)13-18)12-16-9-17(19)7-6-15(16)10-20/h6-7,9,14,18H,4-5,8,11-13H2,1-3H3/t18-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372214 (CHEMBL256620) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCN(CC2CC2)CC1 Show InChI InChI=1S/C18H24ClN3/c1-21(13-16-10-17(19)5-4-15(16)11-20)18-6-8-22(9-7-18)12-14-2-3-14/h4-5,10,14,18H,2-3,6-9,12-13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372233 (CHEMBL436643) Show SMILES CN(Cc1cc(Br)ccc1C#N)C1CCN(C)CC1 Show InChI InChI=1S/C15H20BrN3/c1-18-7-5-15(6-8-18)19(2)11-13-9-14(16)4-3-12(13)10-17/h3-4,9,15H,5-8,11H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50372224 (CHEMBL402425) Show SMILES CC(C)CCN1CCC(CC1)N(C)Cc1cc(Cl)ccc1C#N Show InChI InChI=1S/C19H28ClN3/c1-15(2)6-9-23-10-7-19(8-11-23)22(3)14-17-12-18(20)5-4-16(17)13-21/h4-5,12,15,19H,6-11,14H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human eNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372209 (CHEMBL256249) Show SMILES CN(Cc1cc(Cl)ccc1C#N)C1CCN(C)CC1 Show InChI InChI=1S/C15H20ClN3/c1-18-7-5-15(6-8-18)19(2)11-13-9-14(16)4-3-12(13)10-17/h3-4,9,15H,5-8,11H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372226 (CHEMBL256415) Show SMILES CC(C)CN(Cc1cc(Cl)ccc1C#N)[C@H]1CCCNC1 Show InChI InChI=1S/C17H24ClN3/c1-13(2)11-21(17-4-3-7-20-10-17)12-15-8-16(18)6-5-14(15)9-19/h5-6,8,13,17,20H,3-4,7,10-12H2,1-2H3/t17-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	570	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of cytokine-induced iNOS activity in human DLD1 cells after 24 hrs				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372218 (CHEMBL256376) Show SMILES CCCCN(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C17H24ClN3/c1-2-3-10-21(17-6-8-20-9-7-17)13-15-11-16(18)5-4-14(15)12-19/h4-5,11,17,20H,2-3,6-10,13H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	570	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human iNOS expressed in human DLD1 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372228 (CHEMBL402217) Show SMILES CC(C)CN(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C17H24ClN3/c1-13(2)11-21(17-5-7-20-8-6-17)12-15-9-16(18)4-3-14(15)10-19/h3-4,9,13,17,20H,5-8,11-12H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	570	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of cytokine-induced iNOS activity in human DLD1 cells after 24 hrs				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, endothelial (Homo sapiens (Human))	BDBM50372229 (CHEMBL428248) Show SMILES CC(C)N(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C16H22ClN3/c1-12(2)20(16-5-7-19-8-6-16)11-14-9-15(17)4-3-13(14)10-18/h3-4,9,12,16,19H,5-8,11H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	570	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human eNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50372222 (CHEMBL403952) Show SMILES CCN(Cc1cc(Cl)ccc1C#N)C1CCNCC1 Show InChI InChI=1S/C15H20ClN3/c1-2-19(15-5-7-18-8-6-15)11-13-9-14(16)4-3-12(13)10-17/h3-4,9,15,18H,2,5-8,11H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of cytokine-induced iNOS activity in human DLD1 cells after 24 hrs				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50372232 (CHEMBL256069) Show SMILES CN(Cc1cc(Cl)ccc1Br)C1CCN(C)CC1 Show InChI InChI=1S/C14H20BrClN2/c1-17-7-5-13(6-8-17)18(2)10-11-9-12(16)3-4-14(11)15/h3-4,9,13H,5-8,10H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of human nNOS expressed in insect SF9 cells after 1 hr				Bioorg Med Chem Lett 18: 336-43 (2008) Article DOI: 10.1016/j.bmcl.2007.10.073 BindingDB Entry DOI: 10.7270/Q2H9961Q
					More data for this Ligand-Target Pair

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