Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Myosin light chain kinase, smooth muscle' and Ligand = 'BDBM50015064'   

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
Myosin light chain kinase, smooth muscle (Gallus gallus (chicken))	BDBM50015064 (CHEMBL367267 | Ser-Asn-Val-Phe-Ala-NH-Bzl) Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)NCc1ccccc1 Show InChI InChI=1S/C31H43N7O7/c1-18(2)26(38-30(44)24(15-25(33)40)36-28(42)22(32)17-39)31(45)37-23(14-20-10-6-4-7-11-20)29(43)35-19(3)27(41)34-16-21-12-8-5-9-13-21/h4-13,18-19,22-24,26,39H,14-17,32H2,1-3H3,(H2,33,40)(H,34,41)(H,35,43)(H,36,42)(H,37,45)(H,38,44)/t19-,22-,23-,24-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Curated by ChEMBL					Assay Description Inhibition of native form of chicken MLCK (myosin light chain kinase)				J Med Chem 33: 964-72 (1990) BindingDB Entry DOI: 10.7270/Q21N803V
					More data for this Ligand-Target Pair
Myosin light chain kinase, smooth muscle (Gallus gallus (chicken))	BDBM50015064 (CHEMBL367267 | Ser-Asn-Val-Phe-Ala-NH-Bzl) Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)NCc1ccccc1 Show InChI InChI=1S/C31H43N7O7/c1-18(2)26(38-30(44)24(15-25(33)40)36-28(42)22(32)17-39)31(45)37-23(14-20-10-6-4-7-11-20)29(43)35-19(3)27(41)34-16-21-12-8-5-9-13-21/h4-13,18-19,22-24,26,39H,14-17,32H2,1-3H3,(H2,33,40)(H,34,41)(H,35,43)(H,36,42)(H,37,45)(H,38,44)/t19-,22-,23-,24-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Curated by ChEMBL					Assay Description Inhibition of native form of chicken MLCK (myosin light chain kinase)				J Med Chem 33: 964-72 (1990) BindingDB Entry DOI: 10.7270/Q21N803V
					More data for this Ligand-Target Pair