BDBM50087166 CHEMBL3426728

SMILES: NCc1ccc(cc1-c1cccc(c1)C(=O)Nc1ccc(CC(=O)OC2CCCOC2)cc1)C(=O)Nc1ccncc1F

InChI Key: InChIKey=TYQKKLYDAKRHED-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50087166   

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))	BDBM50087166 (CHEMBL3426728) Show SMILES NCc1ccc(cc1-c1cccc(c1)C(=O)Nc1ccc(CC(=O)OC2CCCOC2)cc1)C(=O)Nc1ccncc1F Show InChI InChI=1S/C33H31FN4O5/c34-29-19-36-13-12-30(29)38-33(41)24-8-9-25(18-35)28(17-24)22-3-1-4-23(16-22)32(40)37-26-10-6-21(7-11-26)15-31(39)43-27-5-2-14-42-20-27/h1,3-4,6-13,16-17,19,27H,2,5,14-15,18,20,35H2,(H,37,40)(H,36,38,41)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	<1	n/a	n/a	n/a	n/a	n/a	n/a
Agoralaan Abis Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged ROCK2 expressed in baculovirus-infected insect cells using long S6 kinase peptide as substrate by radiometr...				J Med Chem 58: 4309-24 (2015) Article DOI: 10.1021/acs.jmedchem.5b00308 BindingDB Entry DOI: 10.7270/Q2H41T4R
					More data for this Ligand-Target Pair
Rho-associated protein kinase 2 (Homo sapiens (Human))	BDBM50087166 (CHEMBL3426728) Show SMILES NCc1ccc(cc1-c1cccc(c1)C(=O)Nc1ccc(CC(=O)OC2CCCOC2)cc1)C(=O)Nc1ccncc1F Show InChI InChI=1S/C33H31FN4O5/c34-29-19-36-13-12-30(29)38-33(41)24-8-9-25(18-35)28(17-24)22-3-1-4-23(16-22)32(40)37-26-10-6-21(7-11-26)15-31(39)43-27-5-2-14-42-20-27/h1,3-4,6-13,16-17,19,27H,2,5,14-15,18,20,35H2,(H,37,40)(H,36,38,41)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	<1	n/a	n/a	n/a	n/a	n/a	n/a
Agoralaan Abis Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged ROCK2 expressed in baculovirus-infected insect cells using long S6 kinase peptide as substrate by radiometr...				J Med Chem 58: 4309-24 (2015) Article DOI: 10.1021/acs.jmedchem.5b00308 BindingDB Entry DOI: 10.7270/Q2H41T4R
					More data for this Ligand-Target Pair