Compile Data Set for Download or QSAR

Found 60 hits Enz. Inhib. hit(s) with all data for entry = 50031216   

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
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309123 (4-(6-(piperazin-1-yl)-5-(pyrrolidin-1-yl)pyrazin-2...) Show SMILES C1CCN(C1)c1ncc(nc1N1CCNCC1)-c1ccnc2[nH]ccc12 Show InChI InChI=1S/C19H23N7/c1-2-10-25(9-1)18-19(26-11-7-20-8-12-26)24-16(13-23-18)14-3-5-21-17-15(14)4-6-22-17/h3-6,13,20H,1-2,7-12H2,(H,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309122 (4-(6-(1,4-diazepan-1-yl)-5-(pyrrolidin-1-yl)pyrazi...) Show SMILES C1CCN(C1)c1ncc(nc1N1CCCNCC1)-c1ccnc2[nH]ccc12 Show InChI InChI=1S/C20H25N7/c1-2-11-26(10-1)19-20(27-12-3-6-21-9-13-27)25-17(14-24-19)15-4-7-22-18-16(15)5-8-23-18/h4-5,7-8,14,21H,1-3,6,9-13H2,(H,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309120 ((1-(6-(pyridin-4-yl)-3-(pyrrolidin-1-yl)pyrazin-2-...) Show SMILES NCC1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C19H26N6/c20-13-15-5-11-25(12-6-15)19-18(24-9-1-2-10-24)22-14-17(23-19)16-3-7-21-8-4-16/h3-4,7-8,14-15H,1-2,5-6,9-13,20H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309123 (4-(6-(piperazin-1-yl)-5-(pyrrolidin-1-yl)pyrazin-2...) Show SMILES C1CCN(C1)c1ncc(nc1N1CCNCC1)-c1ccnc2[nH]ccc12 Show InChI InChI=1S/C19H23N7/c1-2-10-25(9-1)18-19(26-11-7-20-8-12-26)24-16(13-23-18)14-3-5-21-17-15(14)4-6-22-17/h3-6,13,20H,1-2,7-12H2,(H,21,22)	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	34	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309116 (1-(6-(pyridin-4-yl)-3-(pyrrolidin-1-yl)pyrazin-2-y...) Show SMILES C1CCN(C1)c1ncc(nc1N1CCCNCC1)-c1ccncc1 Show InChI InChI=1S/C18H24N6/c1-2-11-23(10-1)17-18(24-12-3-6-19-9-13-24)22-16(14-21-17)15-4-7-20-8-5-15/h4-5,7-8,14,19H,1-3,6,9-13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309121 (CHEMBL602041 | N-methyl-1-(1-(6-(pyridin-4-yl)-3-(...) Show SMILES CNCC1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C20H28N6/c1-21-14-16-6-12-26(13-7-16)20-19(25-10-2-3-11-25)23-15-18(24-20)17-4-8-22-9-5-17/h4-5,8-9,15-16,21H,2-3,6-7,10-14H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309117 (3-(piperazin-1-yl)-5-(pyridin-4-yl)-2-(pyrrolidin-...) Show SMILES C1CCN(C1)c1ncc(nc1N1CCNCC1)-c1ccncc1 Show InChI InChI=1S/C17H22N6/c1-2-10-22(9-1)16-17(23-11-7-19-8-12-23)21-15(13-20-16)14-3-5-18-6-4-14/h3-6,13,19H,1-2,7-12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309118 (1-(6-(pyridin-4-yl)-3-(pyrrolidin-1-yl)pyrazin-2-y...) Show SMILES NC1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C18H24N6/c19-15-5-11-24(12-6-15)18-17(23-9-1-2-10-23)21-13-16(22-18)14-3-7-20-8-4-14/h3-4,7-8,13,15H,1-2,5-6,9-12,19H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309126 (2-(4-(6-(pyridin-4-yl)-3-(pyrrolidin-1-yl)pyrazin-...) Show SMILES OCCN1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C19H26N6O/c26-14-13-23-9-11-25(12-10-23)19-18(24-7-1-2-8-24)21-15-17(22-19)16-3-5-20-6-4-16/h3-6,15,26H,1-2,7-14H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	78	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309124 (1-(3-(pyrrolidin-1-yl)-6-(1H-pyrrolo[2,3-b]pyridin...) Show SMILES NC1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccnc2[nH]ccc12 Show InChI InChI=1S/C20H25N7/c21-14-5-11-27(12-6-14)20-19(26-9-1-2-10-26)24-13-17(25-20)15-3-7-22-18-16(15)4-8-23-18/h3-4,7-8,13-14H,1-2,5-6,9-12,21H2,(H,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	89	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309120 ((1-(6-(pyridin-4-yl)-3-(pyrrolidin-1-yl)pyrazin-2-...) Show SMILES NCC1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C19H26N6/c20-13-15-5-11-25(12-6-15)19-18(24-9-1-2-10-24)22-14-17(23-19)16-3-7-21-8-4-16/h3-4,7-8,14-15H,1-2,5-6,9-13,20H2	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
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309121 (CHEMBL602041 | N-methyl-1-(1-(6-(pyridin-4-yl)-3-(...) Show SMILES CNCC1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C20H28N6/c1-21-14-16-6-12-26(13-7-16)20-19(25-10-2-3-11-25)23-15-18(24-20)17-4-8-22-9-5-17/h4-5,8-9,15-16,21H,2-3,6-7,10-14H2,1H3	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	150	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309122 (4-(6-(1,4-diazepan-1-yl)-5-(pyrrolidin-1-yl)pyrazi...) Show SMILES C1CCN(C1)c1ncc(nc1N1CCCNCC1)-c1ccnc2[nH]ccc12 Show InChI InChI=1S/C20H25N7/c1-2-11-26(10-1)19-20(27-12-3-6-21-9-13-27)25-17(14-24-19)15-4-7-22-18-16(15)5-8-23-18/h4-5,7-8,14,21H,1-3,6,9-13H2,(H,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309119 (CHEMBL591047 | N-methyl-1-(6-(pyridin-4-yl)-3-(pyr...) Show SMILES CNC1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C19H26N6/c1-20-16-6-12-25(13-7-16)19-18(24-10-2-3-11-24)22-14-17(23-19)15-4-8-21-9-5-15/h4-5,8-9,14,16,20H,2-3,6-7,10-13H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD 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
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309118 (1-(6-(pyridin-4-yl)-3-(pyrrolidin-1-yl)pyrazin-2-y...) Show SMILES NC1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C18H24N6/c19-15-5-11-24(12-6-15)18-17(23-9-1-2-10-23)21-13-16(22-18)14-3-7-20-8-4-14/h3-4,7-8,13,15H,1-2,5-6,9-12,19H2	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
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309126 (2-(4-(6-(pyridin-4-yl)-3-(pyrrolidin-1-yl)pyrazin-...) Show SMILES OCCN1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C19H26N6O/c26-14-13-23-9-11-25(12-10-23)19-18(24-7-1-2-8-24)21-15-17(22-19)16-3-5-20-6-4-16/h3-6,15,26H,1-2,7-14H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309125 (2-(4-(3-(dimethylamino)-6-(pyridin-4-yl)pyrazin-2-...) Show SMILES CN(C)c1ncc(nc1N1CCN(CCO)CC1)-c1ccncc1 Show InChI InChI=1S/C17H24N6O/c1-21(2)16-17(23-9-7-22(8-10-23)11-12-24)20-15(13-19-16)14-3-5-18-6-4-14/h3-6,13,24H,7-12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309124 (1-(3-(pyrrolidin-1-yl)-6-(1H-pyrrolo[2,3-b]pyridin...) Show SMILES NC1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccnc2[nH]ccc12 Show InChI InChI=1S/C20H25N7/c21-14-5-11-27(12-6-14)20-19(26-9-1-2-10-26)24-13-17(25-20)15-3-7-22-18-16(15)4-8-23-18/h3-4,7-8,13-14H,1-2,5-6,9-12,21H2,(H,22,23)	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
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309116 (1-(6-(pyridin-4-yl)-3-(pyrrolidin-1-yl)pyrazin-2-y...) Show SMILES C1CCN(C1)c1ncc(nc1N1CCCNCC1)-c1ccncc1 Show InChI InChI=1S/C18H24N6/c1-2-11-23(10-1)17-18(24-12-3-6-19-9-13-24)22-16(14-21-17)15-4-7-20-8-5-15/h4-5,7-8,14,19H,1-3,6,9-13H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309113 (1-methyl-4-(6-(pyridin-4-yl)-3-(pyrrolidin-1-yl)py...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C19H26N6/c1-23-9-4-12-25(14-13-23)19-18(24-10-2-3-11-24)21-15-17(22-19)16-5-7-20-8-6-16/h5-8,15H,2-4,9-14H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309103 (3-(4-methyl-1,4-diazepan-1-yl)-5-(1H-pyrrolo[2,3-b...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1ccnc2[nH]ccc12 Show InChI InChI=1S/C17H21N7/c1-23-7-2-8-24(10-9-23)17-15(18)21-11-14(22-17)12-3-5-19-16-13(12)4-6-20-16/h3-6,11H,2,7-10H2,1H3,(H2,18,21)(H,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309114 (1-methyl-4-(3-(piperidin-1-yl)-6-(pyridin-4-yl)pyr...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N1CCCCC1)-c1ccncc1 Show InChI InChI=1S/C20H28N6/c1-24-10-5-13-26(15-14-24)20-19(25-11-3-2-4-12-25)22-16-18(23-20)17-6-8-21-9-7-17/h6-9,16H,2-5,10-15H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309117 (3-(piperazin-1-yl)-5-(pyridin-4-yl)-2-(pyrrolidin-...) Show SMILES C1CCN(C1)c1ncc(nc1N1CCNCC1)-c1ccncc1 Show InChI InChI=1S/C17H22N6/c1-2-10-22(9-1)16-17(23-11-7-19-8-12-23)21-15(13-20-16)14-3-5-18-6-4-14/h3-6,13,19H,1-2,7-12H2	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	610	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309105 (5-(1H-indazol-5-yl)-3-(4-methyl-1,4-diazepan-1-yl)...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1ccc2[nH]ncc2c1 Show InChI InChI=1S/C17H21N7/c1-23-5-2-6-24(8-7-23)17-16(18)19-11-15(21-17)12-3-4-14-13(9-12)10-20-22-14/h3-4,9-11H,2,5-8H2,1H3,(H2,18,19)(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	950	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309125 (2-(4-(3-(dimethylamino)-6-(pyridin-4-yl)pyrazin-2-...) Show SMILES CN(C)c1ncc(nc1N1CCN(CCO)CC1)-c1ccncc1 Show InChI InChI=1S/C17H24N6O/c1-21(2)16-17(23-9-7-22(8-10-23)11-12-24)20-15(13-19-16)14-3-5-18-6-4-14/h3-6,13,24H,7-12H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309103 (3-(4-methyl-1,4-diazepan-1-yl)-5-(1H-pyrrolo[2,3-b...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1ccnc2[nH]ccc12 Show InChI InChI=1S/C17H21N7/c1-23-7-2-8-24(10-9-23)17-15(18)21-11-14(22-17)12-3-5-19-16-13(12)4-6-20-16/h3-6,11H,2,7-10H2,1H3,(H2,18,21)(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309108 (CHEMBL601834 | N,N-dimethyl-3-(4-methyl-1,4-diazep...) Show SMILES CN(C)c1ncc(nc1N1CCCN(C)CC1)-c1ccncc1 Show InChI InChI=1S/C17H24N6/c1-21(2)16-17(23-10-4-9-22(3)11-12-23)20-15(13-19-16)14-5-7-18-8-6-14/h5-8,13H,4,9-12H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309119 (CHEMBL591047 | N-methyl-1-(6-(pyridin-4-yl)-3-(pyr...) Show SMILES CNC1CCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C19H26N6/c1-20-16-6-12-25(13-7-16)19-18(24-10-2-3-11-24)22-14-17(23-19)15-4-8-21-9-5-15/h4-5,8-9,14,16,20H,2-3,6-7,10-13H2,1H3	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	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309105 (5-(1H-indazol-5-yl)-3-(4-methyl-1,4-diazepan-1-yl)...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1ccc2[nH]ncc2c1 Show InChI InChI=1S/C17H21N7/c1-23-5-2-6-24(8-7-23)17-16(18)19-11-15(21-17)12-3-4-14-13(9-12)10-20-22-14/h3-4,9-11H,2,5-8H2,1H3,(H2,18,19)(H,20,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309107 (CHEMBL589578 | N-methyl-3-(4-methyl-1,4-diazepan-1...) Show SMILES CNc1ncc(nc1N1CCCN(C)CC1)-c1ccncc1 Show InChI InChI=1S/C16H22N6/c1-17-15-16(22-9-3-8-21(2)10-11-22)20-14(12-19-15)13-4-6-18-7-5-13/h4-7,12H,3,8-11H2,1-2H3,(H,17,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309104 (5-(1H-indazol-4-yl)-3-(4-methyl-1,4-diazepan-1-yl)...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1cccc2[nH]ncc12 Show InChI InChI=1S/C17H21N7/c1-23-6-3-7-24(9-8-23)17-16(18)19-11-15(21-17)12-4-2-5-14-13(12)10-20-22-14/h2,4-5,10-11H,3,6-9H2,1H3,(H2,18,19)(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309097 (2-(4-(3-amino-6-(pyridin-4-yl)pyrazin-2-yl)piperaz...) Show SMILES Nc1ncc(nc1N1CCN(CCO)CC1)-c1ccncc1 Show InChI InChI=1S/C15H20N6O/c16-14-15(21-7-5-20(6-8-21)9-10-22)19-13(11-18-14)12-1-3-17-4-2-12/h1-4,11,22H,5-10H2,(H2,16,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309098 (3-(4-methyl-1,4-diazepan-1-yl)-5-(pyridin-4-yl)pyr...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1ccncc1 Show InChI InChI=1S/C15H20N6/c1-20-7-2-8-21(10-9-20)15-14(16)18-11-13(19-15)12-3-5-17-6-4-12/h3-6,11H,2,7-10H2,1H3,(H2,16,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309109 (CHEMBL589336 | N,N-diethyl-3-(4-methyl-1,4-diazepa...) Show SMILES CCN(CC)c1ncc(nc1N1CCCN(C)CC1)-c1ccncc1 Show InChI InChI=1S/C19H28N6/c1-4-24(5-2)18-19(25-12-6-11-23(3)13-14-25)22-17(15-21-18)16-7-9-20-10-8-16/h7-10,15H,4-6,11-14H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309102 (3-(4-methyl-1,4-diazepan-1-yl)-5-(1H-pyrazol-3-yl)...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1cc[nH]n1 Show InChI InChI=1S/C13H19N7/c1-19-5-2-6-20(8-7-19)13-12(14)15-9-11(17-13)10-3-4-16-18-10/h3-4,9H,2,5-8H2,1H3,(H2,14,15)(H,16,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309110 (2-(3-(4-methyl-1,4-diazepan-1-yl)-5-(pyridin-4-yl)...) Show SMILES CN1CCCN(CC1)c1nc(cnc1NCCO)-c1ccncc1 Show InChI InChI=1S/C17H24N6O/c1-22-8-2-9-23(11-10-22)17-16(19-7-12-24)20-13-15(21-17)14-3-5-18-6-4-14/h3-6,13,24H,2,7-12H2,1H3,(H,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309098 (3-(4-methyl-1,4-diazepan-1-yl)-5-(pyridin-4-yl)pyr...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1ccncc1 Show InChI InChI=1S/C15H20N6/c1-20-7-2-8-21(10-9-20)15-14(16)18-11-13(19-15)12-3-5-17-6-4-12/h3-6,11H,2,7-10H2,1H3,(H2,16,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309097 (2-(4-(3-amino-6-(pyridin-4-yl)pyrazin-2-yl)piperaz...) Show SMILES Nc1ncc(nc1N1CCN(CCO)CC1)-c1ccncc1 Show InChI InChI=1S/C15H20N6O/c16-14-15(21-7-5-20(6-8-21)9-10-22)19-13(11-18-14)12-1-3-17-4-2-12/h1-4,11,22H,5-10H2,(H2,16,18)	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	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309113 (1-methyl-4-(6-(pyridin-4-yl)-3-(pyrrolidin-1-yl)py...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N1CCCC1)-c1ccncc1 Show InChI InChI=1S/C19H26N6/c1-23-9-4-12-25(14-13-23)19-18(24-10-2-3-11-24)21-15-17(22-19)16-5-7-20-8-6-16/h5-8,15H,2-4,9-14H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309115 (4-(3-(4-methyl-1,4-diazepan-1-yl)-5-(pyridin-4-yl)...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N1CCOCC1)-c1ccncc1 Show InChI InChI=1S/C19H26N6O/c1-23-7-2-8-24(10-9-23)19-18(25-11-13-26-14-12-25)21-15-17(22-19)16-3-5-20-6-4-16/h3-6,15H,2,7-14H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309108 (CHEMBL601834 | N,N-dimethyl-3-(4-methyl-1,4-diazep...) Show SMILES CN(C)c1ncc(nc1N1CCCN(C)CC1)-c1ccncc1 Show InChI InChI=1S/C17H24N6/c1-21(2)16-17(23-10-4-9-22(3)11-12-23)20-15(13-19-16)14-5-7-18-8-6-14/h5-8,13H,4,9-12H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309109 (CHEMBL589336 | N,N-diethyl-3-(4-methyl-1,4-diazepa...) Show SMILES CCN(CC)c1ncc(nc1N1CCCN(C)CC1)-c1ccncc1 Show InChI InChI=1S/C19H28N6/c1-4-24(5-2)18-19(25-12-6-11-23(3)13-14-25)22-17(15-21-18)16-7-9-20-10-8-16/h7-10,15H,4-6,11-14H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309107 (CHEMBL589578 | N-methyl-3-(4-methyl-1,4-diazepan-1...) Show SMILES CNc1ncc(nc1N1CCCN(C)CC1)-c1ccncc1 Show InChI InChI=1S/C16H22N6/c1-17-15-16(22-9-3-8-21(2)10-11-22)20-14(12-19-15)13-4-6-18-7-5-13/h4-7,12H,3,8-11H2,1-2H3,(H,17,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309104 (5-(1H-indazol-4-yl)-3-(4-methyl-1,4-diazepan-1-yl)...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1cccc2[nH]ncc12 Show InChI InChI=1S/C17H21N7/c1-23-6-3-7-24(9-8-23)17-16(18)19-11-15(21-17)12-4-2-5-14-13(12)10-20-22-14/h2,4-5,10-11H,3,6-9H2,1H3,(H2,18,19)(H,20,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309106 (5-(1H-indazol-6-yl)-3-(4-methyl-1,4-diazepan-1-yl)...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1ccc2cn[nH]c2c1 Show InChI InChI=1S/C17H21N7/c1-23-5-2-6-24(8-7-23)17-16(18)19-11-15(21-17)12-3-4-13-10-20-22-14(13)9-12/h3-4,9-11H,2,5-8H2,1H3,(H2,18,19)(H,20,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309111 (CHEMBL590238 | N-(2-methoxyethyl)-3-(4-methyl-1,4-...) Show SMILES COCCNc1ncc(nc1N1CCCN(C)CC1)-c1ccncc1 Show InChI InChI=1S/C18H26N6O/c1-23-9-3-10-24(12-11-23)18-17(20-8-13-25-2)21-14-16(22-18)15-4-6-19-7-5-15/h4-7,14H,3,8-13H2,1-2H3,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50309106 (5-(1H-indazol-6-yl)-3-(4-methyl-1,4-diazepan-1-yl)...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1ccc2cn[nH]c2c1 Show InChI InChI=1S/C17H21N7/c1-23-5-2-6-24(8-7-23)17-16(18)19-11-15(21-17)12-3-4-13-10-20-22-14(13)9-12/h3-4,9-11H,2,5-8H2,1H3,(H2,18,19)(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK2				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309114 (1-methyl-4-(3-(piperidin-1-yl)-6-(pyridin-4-yl)pyr...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N1CCCCC1)-c1ccncc1 Show InChI InChI=1S/C20H28N6/c1-24-10-5-13-26(15-14-24)20-19(25-11-3-2-4-12-25)22-16-18(23-20)17-6-8-21-9-7-17/h6-9,16H,2-5,10-15H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309101 (5-(2-aminopyridin-4-yl)-3-(4-methyl-1,4-diazepan-1...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1ccnc(N)c1 Show InChI InChI=1S/C15H21N7/c1-21-5-2-6-22(8-7-21)15-14(17)19-10-12(20-15)11-3-4-18-13(16)9-11/h3-4,9-10H,2,5-8H2,1H3,(H2,16,18)(H2,17,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50309102 (3-(4-methyl-1,4-diazepan-1-yl)-5-(1H-pyrazol-3-yl)...) Show SMILES CN1CCCN(CC1)c1nc(cnc1N)-c1cc[nH]n1 Show InChI InChI=1S/C13H19N7/c1-19-5-2-6-20(8-7-19)13-12(14)15-9-11(17-13)10-3-4-16-18-10/h3-4,9H,2,5-8H2,1H3,(H2,14,15)(H,16,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	3.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
AMRI Curated by ChEMBL					Assay Description Inhibition of human recombinant ROCK1				Bioorg Med Chem Lett 20: 1137-40 (2010) Article DOI: 10.1016/j.bmcl.2009.12.012 BindingDB Entry DOI: 10.7270/Q2QR4X7J
					More data for this Ligand-Target Pair

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