BDBM140996 US10570123, Example 199::US8916576, 199

SMILES: CCCC(=O)Nc1cccc(c1)-c1nc(Nc2ccc3[nH]ncc3c2)c2cc(OCCN3CCCC3)ccc2n1

InChI Key: InChIKey=HTROFVQKJODSCL-UHFFFAOYSA-N

Data: 8 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 140996   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM140996 (US10570123, Example 199 | US8916576, 199) Show SMILES CCCC(=O)Nc1cccc(c1)-c1nc(Nc2ccc3[nH]ncc3c2)c2cc(OCCN3CCCC3)ccc2n1 Show InChI InChI=1S/C31H33N7O2/c1-2-6-29(39)33-23-8-5-7-21(17-23)30-35-28-12-10-25(40-16-15-38-13-3-4-14-38)19-26(28)31(36-30)34-24-9-11-27-22(18-24)20-32-37-27/h5,7-12,17-20H,2-4,6,13-16H2,1H3,(H,32,37)(H,33,39)(H,34,35,36)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Surface Logix, Inc. US Patent					Assay Description ROCK-II inhibitory activity can be measured using the ROCK-II Assay Kit (Molecular Devices, inc.; Sunnyvale, Calif.).				US Patent US8916576 (2014) BindingDB Entry DOI: 10.7270/Q2P55M6K
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM140996 (US10570123, Example 199 | US8916576, 199) Show SMILES CCCC(=O)Nc1cccc(c1)-c1nc(Nc2ccc3[nH]ncc3c2)c2cc(OCCN3CCCC3)ccc2n1 Show InChI InChI=1S/C31H33N7O2/c1-2-6-29(39)33-23-8-5-7-21(17-23)30-35-28-12-10-25(40-16-15-38-13-3-4-14-38)19-26(28)31(36-30)34-24-9-11-27-22(18-24)20-32-37-27/h5,7-12,17-20H,2-4,6,13-16H2,1H3,(H,32,37)(H,33,39)(H,34,35,36)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
Surface Logix, Inc. US Patent					Assay Description ROCK-II inhibitory activity can be measured using the ROCK-II Assay Kit (Molecular Devices, inc.; Sunnyvale, Calif.).				US Patent US8916576 (2014) BindingDB Entry DOI: 10.7270/Q2P55M6K
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM140996 (US10570123, Example 199 | US8916576, 199) Show SMILES CCCC(=O)Nc1cccc(c1)-c1nc(Nc2ccc3[nH]ncc3c2)c2cc(OCCN3CCCC3)ccc2n1 Show InChI InChI=1S/C31H33N7O2/c1-2-6-29(39)33-23-8-5-7-21(17-23)30-35-28-12-10-25(40-16-15-38-13-3-4-14-38)19-26(28)31(36-30)34-24-9-11-27-22(18-24)20-32-37-27/h5,7-12,17-20H,2-4,6,13-16H2,1H3,(H,32,37)(H,33,39)(H,34,35,36)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Surface Logix, Inc. US Patent					Assay Description ROCK-II inhibitory activity can be measured using the ROCK-II Assay Kit (Molecular Devices, inc.; Sunnyvale, Calif.).				US Patent US8916576 (2014) BindingDB Entry DOI: 10.7270/Q2P55M6K
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM140996 (US10570123, Example 199 | US8916576, 199) Show SMILES CCCC(=O)Nc1cccc(c1)-c1nc(Nc2ccc3[nH]ncc3c2)c2cc(OCCN3CCCC3)ccc2n1 Show InChI InChI=1S/C31H33N7O2/c1-2-6-29(39)33-23-8-5-7-21(17-23)30-35-28-12-10-25(40-16-15-38-13-3-4-14-38)19-26(28)31(36-30)34-24-9-11-27-22(18-24)20-32-37-27/h5,7-12,17-20H,2-4,6,13-16H2,1H3,(H,32,37)(H,33,39)(H,34,35,36)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
SURFACE LOGIX, LLC US Patent					Assay Description ROCK-II inhibitory activity can be measured using the ROCK-II Assay Kit (Molecular Devices, inc.; Sunnyvale, Calif.).				US Patent US10570123 (2020) BindingDB Entry DOI: 10.7270/Q2542R1V
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM140996 (US10570123, Example 199 | US8916576, 199) Show SMILES CCCC(=O)Nc1cccc(c1)-c1nc(Nc2ccc3[nH]ncc3c2)c2cc(OCCN3CCCC3)ccc2n1 Show InChI InChI=1S/C31H33N7O2/c1-2-6-29(39)33-23-8-5-7-21(17-23)30-35-28-12-10-25(40-16-15-38-13-3-4-14-38)19-26(28)31(36-30)34-24-9-11-27-22(18-24)20-32-37-27/h5,7-12,17-20H,2-4,6,13-16H2,1H3,(H,32,37)(H,33,39)(H,34,35,36)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9.60	n/a	n/a	n/a	n/a	n/a	n/a
SURFACE LOGIX, LLC US Patent					Assay Description ROCK-II inhibitory activity can be measured using the ROCK-II Assay Kit (Molecular Devices, inc.; Sunnyvale, Calif.).				US Patent US10570123 (2020) BindingDB Entry DOI: 10.7270/Q2542R1V
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM140996 (US10570123, Example 199 | US8916576, 199) Show SMILES CCCC(=O)Nc1cccc(c1)-c1nc(Nc2ccc3[nH]ncc3c2)c2cc(OCCN3CCCC3)ccc2n1 Show InChI InChI=1S/C31H33N7O2/c1-2-6-29(39)33-23-8-5-7-21(17-23)30-35-28-12-10-25(40-16-15-38-13-3-4-14-38)19-26(28)31(36-30)34-24-9-11-27-22(18-24)20-32-37-27/h5,7-12,17-20H,2-4,6,13-16H2,1H3,(H,32,37)(H,33,39)(H,34,35,36)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
SURFACE LOGIX, LLC US Patent					Assay Description ROCK-II inhibitory activity can be measured using the ROCK-II Assay Kit (Molecular Devices, inc.; Sunnyvale, Calif.).				US Patent US10570123 (2020) BindingDB Entry DOI: 10.7270/Q2542R1V
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM140996 (US10570123, Example 199 | US8916576, 199) Show SMILES CCCC(=O)Nc1cccc(c1)-c1nc(Nc2ccc3[nH]ncc3c2)c2cc(OCCN3CCCC3)ccc2n1 Show InChI InChI=1S/C31H33N7O2/c1-2-6-29(39)33-23-8-5-7-21(17-23)30-35-28-12-10-25(40-16-15-38-13-3-4-14-38)19-26(28)31(36-30)34-24-9-11-27-22(18-24)20-32-37-27/h5,7-12,17-20H,2-4,6,13-16H2,1H3,(H,32,37)(H,33,39)(H,34,35,36)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
SURFACE LOGIX, LLC US Patent					Assay Description ROCK-II inhibitory activity can be measured using the ROCK-II Assay Kit (Molecular Devices, inc.; Sunnyvale, Calif.).				US Patent US10570123 (2020) BindingDB Entry DOI: 10.7270/Q2542R1V
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM140996 (US10570123, Example 199 | US8916576, 199) Show SMILES CCCC(=O)Nc1cccc(c1)-c1nc(Nc2ccc3[nH]ncc3c2)c2cc(OCCN3CCCC3)ccc2n1 Show InChI InChI=1S/C31H33N7O2/c1-2-6-29(39)33-23-8-5-7-21(17-23)30-35-28-12-10-25(40-16-15-38-13-3-4-14-38)19-26(28)31(36-30)34-24-9-11-27-22(18-24)20-32-37-27/h5,7-12,17-20H,2-4,6,13-16H2,1H3,(H,32,37)(H,33,39)(H,34,35,36)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Surface Logix, Inc. US Patent					Assay Description ROCK-II inhibitory activity can be measured using the ROCK-II Assay Kit (Molecular Devices, inc.; Sunnyvale, Calif.).				US Patent US8916576 (2014) BindingDB Entry DOI: 10.7270/Q2P55M6K
					More data for this Ligand-Target Pair