Compile Data Set for Download or QSAR

Found 73 hits Enz. Inhib. hit(s) with all data for entry = 50034196   

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))	BDBM50358711 (CHEMBL1922126) Show SMILES COc1cccc(CN(CCCN(C)C)C(=O)c2cn(C)c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C26H31N5O2/c1-29(2)11-6-12-31(17-19-7-5-8-22(13-19)33-4)26(32)24-18-30(3)25-14-20(9-10-23(24)25)21-15-27-28-16-21/h5,7-10,13-16,18H,6,11-12,17H2,1-4H3,(H,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358712 (CHEMBL1922127) Show SMILES COc1cccc(CN(CCN(C)C)C(=O)c2cn(C)c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H29N5O2/c1-28(2)10-11-30(16-18-6-5-7-21(12-18)32-4)25(31)23-17-29(3)24-13-19(8-9-22(23)24)20-14-26-27-15-20/h5-9,12-15,17H,10-11,16H2,1-4H3,(H,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358713 (CHEMBL1922128) Show SMILES COc1cccc(CNC(=O)c2cn(CCCO)c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C23H24N4O3/c1-30-19-5-2-4-16(10-19)12-24-23(29)21-15-27(8-3-9-28)22-11-17(6-7-20(21)22)18-13-25-26-14-18/h2,4-7,10-11,13-15,28H,3,8-9,12H2,1H3,(H,24,29)(H,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358480 (CHEMBL1922132) Show SMILES COc1cccc(CNC(=O)c2c[nH]c3nc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C19H17N5O2/c1-26-14-4-2-3-12(7-14)8-21-19(25)16-11-20-18-15(16)5-6-17(24-18)13-9-22-23-10-13/h2-7,9-11H,8H2,1H3,(H,20,24)(H,21,25)(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	2	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358476 (CHEMBL1922034) Show SMILES COc1cccc(CNC(=O)c2cc3ccc(nc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C19H17N5O2/c1-26-15-4-2-3-12(7-15)9-20-19(25)17-8-13-5-6-16(23-18(13)24-17)14-10-21-22-11-14/h2-8,10-11H,9H2,1H3,(H,20,25)(H,21,22)(H,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358695 (CHEMBL1922035) Show SMILES COc1cccc(CNC(=O)c2cc3ccc(nc3n2C)-c2cn[nH]c2)c1 Show InChI InChI=1S/C20H19N5O2/c1-25-18(20(26)21-10-13-4-3-5-16(8-13)27-2)9-14-6-7-17(24-19(14)25)15-11-22-23-12-15/h3-9,11-12H,10H2,1-2H3,(H,21,26)(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	2	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358469 (CHEMBL1922026) Show SMILES COc1cccc(CNC(=O)c2cc3ccc(cc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C20H18N4O2/c1-26-17-4-2-3-13(7-17)10-21-20(25)19-9-15-6-5-14(8-18(15)24-19)16-11-22-23-12-16/h2-9,11-12,24H,10H2,1H3,(H,21,25)(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	2	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358709 (CHEMBL1922046) Show SMILES COc1cccc(CN(C)C(=O)c2c[nH]c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C21H20N4O2/c1-25(13-14-4-3-5-17(8-14)27-2)21(26)19-12-22-20-9-15(6-7-18(19)20)16-10-23-24-11-16/h3-12,22H,13H2,1-2H3,(H,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358687 (CHEMBL1922139) Show SMILES COc1cccc(CNC(=O)c2[nH]c3cc(ccc3c2CN2CCOCC2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H27N5O3/c1-32-20-4-2-3-17(11-20)13-26-25(31)24-22(16-30-7-9-33-10-8-30)21-6-5-18(12-23(21)29-24)19-14-27-28-15-19/h2-6,11-12,14-15,29H,7-10,13,16H2,1H3,(H,26,31)(H,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358720 (CHEMBL1922124) Show SMILES COc1cccc(CN(C)C(=O)c2cn(C)c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C22H22N4O2/c1-25-14-20(19-8-7-16(10-21(19)25)17-11-23-24-12-17)22(27)26(2)13-15-5-4-6-18(9-15)28-3/h4-12,14H,13H2,1-3H3,(H,23,24)	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	3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358713 (CHEMBL1922128) Show SMILES COc1cccc(CNC(=O)c2cn(CCCO)c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C23H24N4O3/c1-30-19-5-2-4-16(10-19)12-24-23(29)21-15-27(8-3-9-28)22-11-17(6-7-20(21)22)18-13-25-26-14-18/h2,4-7,10-11,13-15,28H,3,8-9,12H2,1H3,(H,24,29)(H,25,26)	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	3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358698 (CHEMBL1922029) Show SMILES COc1cccc(CN(C)C(=O)c2cc3ccc(cc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C21H20N4O2/c1-25(13-14-4-3-5-18(8-14)27-2)21(26)20-10-16-7-6-15(9-19(16)24-20)17-11-22-23-12-17/h3-12,24H,13H2,1-2H3,(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	3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358706 (CHEMBL1922042) Show SMILES COc1cccc(CN(C)C(=O)c2cc3ccc(nc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C20H19N5O2/c1-25(12-13-4-3-5-16(8-13)27-2)20(26)18-9-14-6-7-17(23-19(14)24-18)15-10-21-22-11-15/h3-11H,12H2,1-2H3,(H,21,22)(H,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358721 (CHEMBL1922129) Show SMILES COc1cccc(CNC(=O)c2cn(CCN(C)C)c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C24H27N5O2/c1-28(2)9-10-29-16-22(24(30)25-13-17-5-4-6-20(11-17)31-3)21-8-7-18(12-23(21)29)19-14-26-27-15-19/h4-8,11-12,14-16H,9-10,13H2,1-3H3,(H,25,30)(H,26,27)	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	5	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358710 (CHEMBL1922125) Show SMILES COc1cccc(CNC(=O)c2cn(-c3ccccc3)c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C26H22N4O2/c1-32-22-9-5-6-18(12-22)14-27-26(31)24-17-30(21-7-3-2-4-8-21)25-13-19(10-11-23(24)25)20-15-28-29-16-20/h2-13,15-17H,14H2,1H3,(H,27,31)(H,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358716 (CHEMBL1922133) Show SMILES COc1cccc(CN(C2CC2)C(=O)c2c[nH]c3nc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C22H21N5O2/c1-29-17-4-2-3-14(9-17)13-27(16-5-6-16)22(28)19-12-23-21-18(19)7-8-20(26-21)15-10-24-25-11-15/h2-4,7-12,16H,5-6,13H2,1H3,(H,23,26)(H,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358688 (CHEMBL1922140) Show SMILES COc1cccc(CNC(=O)c2[nH]c3cc(ccc3c2CN2CCN(C)CC2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C26H30N6O2/c1-31-8-10-32(11-9-31)17-23-22-7-6-19(20-15-28-29-16-20)13-24(22)30-25(23)26(33)27-14-18-4-3-5-21(12-18)34-2/h3-7,12-13,15-16,30H,8-11,14,17H2,1-2H3,(H,27,33)(H,28,29)	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	6	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358707 (CHEMBL1922043) Show SMILES COc1cccc(CN(C2CC2)C(=O)c2cc3ccc(nc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C22H21N5O2/c1-29-18-4-2-3-14(9-18)13-27(17-6-7-17)22(28)20-10-15-5-8-19(25-21(15)26-20)16-11-23-24-12-16/h2-5,8-12,17H,6-7,13H2,1H3,(H,23,24)(H,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358689 (CHEMBL1922141) Show SMILES COc1cccc(CNC(=O)c2[nH]c3cc(ccc3c2CN2CCCNCC2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C26H30N6O2/c1-34-21-5-2-4-18(12-21)14-28-26(33)25-23(17-32-10-3-8-27-9-11-32)22-7-6-19(13-24(22)31-25)20-15-29-30-16-20/h2,4-7,12-13,15-16,27,31H,3,8-11,14,17H2,1H3,(H,28,33)(H,29,30)	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	8	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358690 (CHEMBL1922142) Show SMILES COc1cccc(CNC(=O)c2[nH]c3nc(ccc3c2CN2CCN(C)CC2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H29N7O2/c1-31-8-10-32(11-9-31)16-21-20-6-7-22(18-14-27-28-15-18)29-24(20)30-23(21)25(33)26-13-17-4-3-5-19(12-17)34-2/h3-7,12,14-15H,8-11,13,16H2,1-2H3,(H,26,33)(H,27,28)(H,29,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358719 (CHEMBL1922137) Show SMILES COc1cccc(CNC(=O)c2cn(CCN3CCCC3)c3nc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H28N6O2/c1-33-20-6-4-5-18(13-20)14-26-25(32)22-17-31(12-11-30-9-2-3-10-30)24-21(22)7-8-23(29-24)19-15-27-28-16-19/h4-8,13,15-17H,2-3,9-12,14H2,1H3,(H,26,32)(H,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358686 (CHEMBL1922138) Show SMILES COc1cccc(CNC(=O)c2[nH]c3cc(ccc3c2CN(C)C)-c2cn[nH]c2)c1 Show InChI InChI=1S/C23H25N5O2/c1-28(2)14-20-19-8-7-16(17-12-25-26-13-17)10-21(19)27-22(20)23(29)24-11-15-5-4-6-18(9-15)30-3/h4-10,12-13,27H,11,14H2,1-3H3,(H,24,29)(H,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358714 (CHEMBL1922130) Show SMILES COc1cccc(CN(C)C(=O)c2cn(CCN(C)C)c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H29N5O2/c1-28(2)10-11-30-17-23(22-9-8-19(13-24(22)30)20-14-26-27-15-20)25(31)29(3)16-18-6-5-7-21(12-18)32-4/h5-9,12-15,17H,10-11,16H2,1-4H3,(H,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358712 (CHEMBL1922127) Show SMILES COc1cccc(CN(CCN(C)C)C(=O)c2cn(C)c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H29N5O2/c1-28(2)10-11-30(16-18-6-5-7-21(12-18)32-4)25(31)23-17-29(3)24-13-19(8-9-22(23)24)20-14-26-27-15-20/h5-9,12-15,17H,10-11,16H2,1-4H3,(H,26,27)	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	9	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358694 (CHEMBL1922033) Show SMILES COc1cccc(CN(CCCN(C)C)C(=O)c2cc3ccc(cc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H29N5O2/c1-29(2)10-5-11-30(17-18-6-4-7-22(12-18)32-3)25(31)24-14-20-9-8-19(13-23(20)28-24)21-15-26-27-16-21/h4,6-9,12-16,28H,5,10-11,17H2,1-3H3,(H,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358480 (CHEMBL1922132) Show SMILES COc1cccc(CNC(=O)c2c[nH]c3nc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C19H17N5O2/c1-26-14-4-2-3-12(7-14)8-21-19(25)16-11-20-18-15(16)5-6-17(24-18)13-9-22-23-10-13/h2-7,9-11H,8H2,1H3,(H,20,24)(H,21,25)(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	11	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358693 (CHEMBL1922032) Show SMILES COc1cccc(CN(CCN2CCCC2)C(=O)c2cc3ccc(cc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C26H29N5O2/c1-33-23-6-4-5-19(13-23)18-31(12-11-30-9-2-3-10-30)26(32)25-15-21-8-7-20(14-24(21)29-25)22-16-27-28-17-22/h4-8,13-17,29H,2-3,9-12,18H2,1H3,(H,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358476 (CHEMBL1922034) Show SMILES COc1cccc(CNC(=O)c2cc3ccc(nc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C19H17N5O2/c1-26-15-4-2-3-12(7-15)9-20-19(25)17-8-13-5-6-16(23-18(13)24-17)14-10-21-22-11-14/h2-8,10-11H,9H2,1H3,(H,20,25)(H,21,22)(H,23,24)	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	12	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358711 (CHEMBL1922126) Show SMILES COc1cccc(CN(CCCN(C)C)C(=O)c2cn(C)c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C26H31N5O2/c1-29(2)11-6-12-31(17-19-7-5-8-22(13-19)33-4)26(32)24-18-30(3)25-14-20(9-10-23(24)25)21-15-27-28-16-21/h5,7-10,13-16,18H,6,11-12,17H2,1-4H3,(H,27,28)	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	13	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358691 (CHEMBL1922143) Show SMILES COc1cccc(CNC(=O)c2[nH]c3nc(ccc3c2CN2CCOCC2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C24H26N6O3/c1-32-18-4-2-3-16(11-18)12-25-24(31)22-20(15-30-7-9-33-10-8-30)19-5-6-21(28-23(19)29-22)17-13-26-27-14-17/h2-6,11,13-14H,7-10,12,15H2,1H3,(H,25,31)(H,26,27)(H,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358708 (CHEMBL1922044) Show SMILES COc1cccc(CN(CCN2CCCC2)C(=O)c2cc3ccc(nc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H28N6O2/c1-33-21-6-4-5-18(13-21)17-31(12-11-30-9-2-3-10-30)25(32)23-14-19-7-8-22(28-24(19)29-23)20-15-26-27-16-20/h4-8,13-16H,2-3,9-12,17H2,1H3,(H,26,27)(H,28,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358717 (CHEMBL1922134) Show SMILES CCN(Cc1cccc(OC)c1)C(=O)c1c[nH]c2nc(ccc12)-c1cn[nH]c1 Show InChI InChI=1S/C21H21N5O2/c1-3-26(13-14-5-4-6-16(9-14)28-2)21(27)18-12-22-20-17(18)7-8-19(25-20)15-10-23-24-11-15/h4-12H,3,13H2,1-2H3,(H,22,25)(H,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358709 (CHEMBL1922046) Show SMILES COc1cccc(CN(C)C(=O)c2c[nH]c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C21H20N4O2/c1-25(13-14-4-3-5-17(8-14)27-2)21(26)19-12-22-20-9-15(6-7-18(19)20)16-10-23-24-11-16/h3-12,22H,13H2,1-2H3,(H,23,24)	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	19	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358469 (CHEMBL1922026) Show SMILES COc1cccc(CNC(=O)c2cc3ccc(cc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C20H18N4O2/c1-26-17-4-2-3-13(7-17)10-21-20(25)19-9-15-6-5-14(8-18(15)24-19)16-11-22-23-12-16/h2-9,11-12,24H,10H2,1H3,(H,21,25)(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	19	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358710 (CHEMBL1922125) Show SMILES COc1cccc(CNC(=O)c2cn(-c3ccccc3)c3cc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C26H22N4O2/c1-32-22-9-5-6-18(12-22)14-27-26(31)24-17-30(21-7-3-2-4-8-21)25-13-19(10-11-23(24)25)20-15-28-29-16-20/h2-13,15-17H,14H2,1H3,(H,27,31)(H,28,29)	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	21	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358703 (CHEMBL1922039) Show SMILES COc1cccc(CNC(=O)c2cc3ccc(nc3n2CCCO)-c2cn[nH]c2)c1 Show InChI InChI=1S/C22H23N5O3/c1-30-18-5-2-4-15(10-18)12-23-22(29)20-11-16-6-7-19(17-13-24-25-14-17)26-21(16)27(20)8-3-9-28/h2,4-7,10-11,13-14,28H,3,8-9,12H2,1H3,(H,23,29)(H,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358696 (CHEMBL1922027) Show SMILES COc1cccc(CNC(=O)c2cc3ccc(cc3n2CCCO)-c2cn[nH]c2)c1 Show InChI InChI=1S/C23H24N4O3/c1-30-20-5-2-4-16(10-20)13-24-23(29)22-12-18-7-6-17(19-14-25-26-15-19)11-21(18)27(22)8-3-9-28/h2,4-7,10-12,14-15,28H,3,8-9,13H2,1H3,(H,24,29)(H,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358706 (CHEMBL1922042) Show SMILES COc1cccc(CN(C)C(=O)c2cc3ccc(nc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C20H19N5O2/c1-25(12-13-4-3-5-16(8-13)27-2)20(26)18-9-14-6-7-17(23-19(14)24-18)15-10-21-22-11-15/h3-11H,12H2,1-2H3,(H,21,22)(H,23,24)	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	27	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358716 (CHEMBL1922133) Show SMILES COc1cccc(CN(C2CC2)C(=O)c2c[nH]c3nc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C22H21N5O2/c1-29-17-4-2-3-14(9-17)13-27(16-5-6-16)22(28)19-12-23-21-18(19)7-8-20(26-21)15-10-24-25-11-15/h2-4,7-12,16H,5-6,13H2,1H3,(H,23,26)(H,24,25)	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	30	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358707 (CHEMBL1922043) Show SMILES COc1cccc(CN(C2CC2)C(=O)c2cc3ccc(nc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C22H21N5O2/c1-29-18-4-2-3-14(9-18)13-27(17-6-7-17)22(28)20-10-15-5-8-19(25-21(15)26-20)16-11-23-24-12-16/h2-5,8-12,17H,6-7,13H2,1H3,(H,23,24)(H,25,26)	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	33	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358686 (CHEMBL1922138) Show SMILES COc1cccc(CNC(=O)c2[nH]c3cc(ccc3c2CN(C)C)-c2cn[nH]c2)c1 Show InChI InChI=1S/C23H25N5O2/c1-28(2)14-20-19-8-7-16(17-12-25-26-13-17)10-21(19)27-22(20)23(29)24-11-15-5-4-6-18(9-15)30-3/h4-10,12-13,27H,11,14H2,1-3H3,(H,24,29)(H,25,26)	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
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358698 (CHEMBL1922029) Show SMILES COc1cccc(CN(C)C(=O)c2cc3ccc(cc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C21H20N4O2/c1-25(13-14-4-3-5-18(8-14)27-2)21(26)20-10-16-7-6-15(9-19(16)24-20)17-11-22-23-12-17/h3-12,24H,13H2,1-2H3,(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	37	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358690 (CHEMBL1922142) Show SMILES COc1cccc(CNC(=O)c2[nH]c3nc(ccc3c2CN2CCN(C)CC2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H29N7O2/c1-31-8-10-32(11-9-31)16-21-20-6-7-22(18-14-27-28-15-18)29-24(20)30-23(21)25(33)26-13-17-4-3-5-19(12-17)34-2/h3-7,12,14-15H,8-11,13,16H2,1-2H3,(H,26,33)(H,27,28)(H,29,30)	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	39	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358687 (CHEMBL1922139) Show SMILES COc1cccc(CNC(=O)c2[nH]c3cc(ccc3c2CN2CCOCC2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H27N5O3/c1-32-20-4-2-3-17(11-20)13-26-25(31)24-22(16-30-7-9-33-10-8-30)21-6-5-18(12-23(21)29-24)19-14-27-28-15-19/h2-6,11-12,14-15,29H,7-10,13,16H2,1H3,(H,26,31)(H,27,28)	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	40	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358702 (CHEMBL1922038) Show SMILES COc1cccc(CNC(=O)c2cc3ccc(nc3n2CCN(C)C)-c2cn[nH]c2)c1 Show InChI InChI=1S/C23H26N6O2/c1-28(2)9-10-29-21(23(30)24-13-16-5-4-6-19(11-16)31-3)12-17-7-8-20(27-22(17)29)18-14-25-26-15-18/h4-8,11-12,14-15H,9-10,13H2,1-3H3,(H,24,30)(H,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358694 (CHEMBL1922033) Show SMILES COc1cccc(CN(CCCN(C)C)C(=O)c2cc3ccc(cc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C25H29N5O2/c1-29(2)10-5-11-30(17-18-6-4-7-22(12-18)32-3)25(31)24-14-20-9-8-19(13-23(20)28-24)21-15-26-27-16-21/h4,6-9,12-16,28H,5,10-11,17H2,1-3H3,(H,26,27)	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	46	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358693 (CHEMBL1922032) Show SMILES COc1cccc(CN(CCN2CCCC2)C(=O)c2cc3ccc(cc3[nH]2)-c2cn[nH]c2)c1 Show InChI InChI=1S/C26H29N5O2/c1-33-23-6-4-5-19(13-23)18-31(12-11-30-9-2-3-10-30)26(32)25-15-21-8-7-20(14-24(21)29-25)22-16-27-28-17-22/h4-8,13-17,29H,2-3,9-12,18H2,1H3,(H,27,28)	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	62	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50358718 (CHEMBL1922135) Show SMILES COc1cccc(CN(CCCN2CCN(C)CC2)C(=O)c2c[nH]c3nc(ccc23)-c2cn[nH]c2)c1 Show InChI InChI=1S/C27H33N7O2/c1-32-11-13-33(14-12-32)9-4-10-34(19-20-5-3-6-22(15-20)36-2)27(35)24-18-28-26-23(24)7-8-25(31-26)21-16-29-30-17-21/h3,5-8,15-18H,4,9-14,19H2,1-2H3,(H,28,31)(H,29,30)	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
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK2				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358717 (CHEMBL1922134) Show SMILES CCN(Cc1cccc(OC)c1)C(=O)c1c[nH]c2nc(ccc12)-c1cn[nH]c1 Show InChI InChI=1S/C21H21N5O2/c1-3-26(13-14-5-4-6-16(9-14)28-2)21(27)18-12-22-20-17(18)7-8-19(25-20)15-10-23-24-11-15/h4-12H,3,13H2,1-2H3,(H,22,25)(H,23,24)	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	76	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair
Rho-associated protein kinase 1 (Homo sapiens (Human))	BDBM50358696 (CHEMBL1922027) Show SMILES COc1cccc(CNC(=O)c2cc3ccc(cc3n2CCCO)-c2cn[nH]c2)c1 Show InChI InChI=1S/C23H24N4O3/c1-30-20-5-2-4-16(10-20)13-24-23(29)22-12-18-7-6-17(19-14-25-26-15-19)11-21(18)27(22)8-3-9-28/h2,4-7,10-12,14-15,28H,3,8-9,13H2,1H3,(H,24,29)(H,25,26)	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	88	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Curated by ChEMBL					Assay Description Inhibition of ROCK1				Bioorg Med Chem Lett 21: 7113-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.084 BindingDB Entry DOI: 10.7270/Q2F1905N
					More data for this Ligand-Target Pair

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