BDBM50535090 CHEMBL4449815

SMILES: Cc1ccc(cc1)-c1cc2nc[nH]c(=O)c2c(NC[C@H]2CCCNC2)n1

InChI Key: InChIKey=LHOLZQIYHWNEJC-AWEZNQCLSA-N

Data: 4 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 4 hits for monomerid = 50535090   

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
1,3-beta-glucan synthase component GLS2 (Saccharomyces cerevisiae)	BDBM50535090 (CHEMBL4449815) Show SMILES Cc1ccc(cc1)-c1cc2nc[nH]c(=O)c2c(NC[C@H]2CCCNC2)n1 |r| Show InChI InChI=1S/C20H23N5O/c1-13-4-6-15(7-5-13)16-9-17-18(20(26)24-12-23-17)19(25-16)22-11-14-3-2-8-21-10-14/h4-7,9,12,14,21H,2-3,8,10-11H2,1H3,(H,22,25)(H,23,24,26)/t14-/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.94E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of human ERG expressed in CHOK1 cell membranes after 2 hrs by cy3b-dofetilide-based fluorescence polarization assay				Bioorg Med Chem Lett 26: 4606-4612 (2016) Article DOI: 10.1016/j.bmcl.2016.08.070
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Homo sapiens (Human))	BDBM50535090 (CHEMBL4449815) Show SMILES Cc1ccc(cc1)-c1cc2nc[nH]c(=O)c2c(NC[C@H]2CCCNC2)n1 |r| Show InChI InChI=1S/C20H23N5O/c1-13-4-6-15(7-5-13)16-9-17-18(20(26)24-12-23-17)19(25-16)22-11-14-3-2-8-21-10-14/h4-7,9,12,14,21H,2-3,8,10-11H2,1H3,(H,22,25)(H,23,24,26)/t14-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	158	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of N-terminal 6His-tagged full length human recombinant SYK expressed in baculovirus using Biotin-AAAEEIYGEI as substrate after 60 mins by...				Bioorg Med Chem Lett 26: 4606-4612 (2016) Article DOI: 10.1016/j.bmcl.2016.08.070
					More data for this Ligand-Target Pair
Tyrosine-protein kinase SYK (Homo sapiens (Human))	BDBM50535090 (CHEMBL4449815) Show SMILES Cc1ccc(cc1)-c1cc2nc[nH]c(=O)c2c(NC[C@H]2CCCNC2)n1 |r| Show InChI InChI=1S/C20H23N5O/c1-13-4-6-15(7-5-13)16-9-17-18(20(26)24-12-23-17)19(25-16)22-11-14-3-2-8-21-10-14/h4-7,9,12,14,21H,2-3,8,10-11H2,1H3,(H,22,25)(H,23,24,26)/t14-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.98E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of SYK in human B cells assessed as suppression of anti-IgM-induced CD69 surface expression preincubated for 30 mins followed by anti-IgM ...				Bioorg Med Chem Lett 26: 4606-4612 (2016) Article DOI: 10.1016/j.bmcl.2016.08.070
					More data for this Ligand-Target Pair
Aurora kinase B (Homo sapiens (Human))	BDBM50535090 (CHEMBL4449815) Show SMILES Cc1ccc(cc1)-c1cc2nc[nH]c(=O)c2c(NC[C@H]2CCCNC2)n1 |r| Show InChI InChI=1S/C20H23N5O/c1-13-4-6-15(7-5-13)16-9-17-18(20(26)24-12-23-17)19(25-16)22-11-14-3-2-8-21-10-14/h4-7,9,12,14,21H,2-3,8,10-11H2,1H3,(H,22,25)(H,23,24,26)/t14-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline R&D Curated by ChEMBL					Assay Description Inhibition of N-terminal-6His-tagged full length human Aurora B expressed in baculovirus using 5FAM-PKA-tide as substrate after 120 mins by fluoresce...				Bioorg Med Chem Lett 26: 4606-4612 (2016) Article DOI: 10.1016/j.bmcl.2016.08.070
					More data for this Ligand-Target Pair