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SMILES: CCn1c(C(N)=O)c(c2c1-c1ccncc1OC2(C)C)-c1ccccc1C(F)(F)F

InChI Key: InChIKey=WBHQPLISMLDBLH-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 350248   

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
Cyclin-C/Cyclin-dependent kinase 8 (Homo sapiens (Human))	BDBM350248 (US10208056, Compound 75) Show SMILES CCn1c(C(N)=O)c(c2c1-c1ccncc1OC2(C)C)-c1ccccc1C(F)(F)F |(-2.34,4.02,;-.85,3.62,;-.45,2.13,;1.07,1.89,;2.16,2.98,;1.76,4.47,;3.64,2.58,;1.31,.37,;-.06,-.33,;-1.15,.76,;-2.64,.36,;-3.73,1.45,;-5.22,1.05,;-5.62,-.44,;-4.53,-1.53,;-3.04,-1.13,;-1.95,-2.22,;-.46,-1.82,;-.86,-3.31,;1.02,-1.42,;2.64,-.4,;3.73,.69,;5.22,.29,;5.62,-1.2,;4.53,-2.29,;3.04,-1.89,;1.95,-2.98,;2.35,-4.47,;.46,-2.58,;.86,-4.07,)| Show InChI InChI=1S/C22H20F3N3O2/c1-4-28-18-13-9-10-27-11-15(13)30-21(2,3)17(18)16(19(28)20(26)29)12-7-5-6-8-14(12)22(23,24)25/h5-11H,4H2,1-3H3,(H2,26,29)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	14.4	n/a	n/a	n/a	n/a	n/a	n/a
FUNDACIÓN DEL SECTOR PÚBLICO ESTATAL CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS CARLOS III (F.S.P. CNIO) US Patent					Assay Description The binding assay relies on the LanthaScreen™ Eu-Kinase Binding Assay (Invitrogen. This is a kinase assay platform based on measuring the binding and...				US Patent US10208056 (2019) BindingDB Entry DOI: 10.7270/Q2GB266B
					More data for this Ligand-Target Pair
Cyclin-C/Cyclin-dependent kinase 19 (Homo sapiens (Human))	BDBM350248 (US10208056, Compound 75) Show SMILES CCn1c(C(N)=O)c(c2c1-c1ccncc1OC2(C)C)-c1ccccc1C(F)(F)F |(-2.34,4.02,;-.85,3.62,;-.45,2.13,;1.07,1.89,;2.16,2.98,;1.76,4.47,;3.64,2.58,;1.31,.37,;-.06,-.33,;-1.15,.76,;-2.64,.36,;-3.73,1.45,;-5.22,1.05,;-5.62,-.44,;-4.53,-1.53,;-3.04,-1.13,;-1.95,-2.22,;-.46,-1.82,;-.86,-3.31,;1.02,-1.42,;2.64,-.4,;3.73,.69,;5.22,.29,;5.62,-1.2,;4.53,-2.29,;3.04,-1.89,;1.95,-2.98,;2.35,-4.47,;.46,-2.58,;.86,-4.07,)| Show InChI InChI=1S/C22H20F3N3O2/c1-4-28-18-13-9-10-27-11-15(13)30-21(2,3)17(18)16(19(28)20(26)29)12-7-5-6-8-14(12)22(23,24)25/h5-11H,4H2,1-3H3,(H2,26,29)	PDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16.7	n/a	n/a	n/a	n/a	n/a	n/a
FUNDACIÓN DEL SECTOR PÚBLICO ESTATAL CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS CARLOS III (F.S.P. CNIO) US Patent					Assay Description The binding assay relies on the LanthaScreen™ Eu-Kinase Binding Assay (Invitrogen). This is a kinase assay platform based on measuring the binding an...				US Patent US10208056 (2019) BindingDB Entry DOI: 10.7270/Q2GB266B
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase haspin (Homo sapiens (Human))	BDBM350248 (US10208056, Compound 75) Show SMILES CCn1c(C(N)=O)c(c2c1-c1ccncc1OC2(C)C)-c1ccccc1C(F)(F)F |(-2.34,4.02,;-.85,3.62,;-.45,2.13,;1.07,1.89,;2.16,2.98,;1.76,4.47,;3.64,2.58,;1.31,.37,;-.06,-.33,;-1.15,.76,;-2.64,.36,;-3.73,1.45,;-5.22,1.05,;-5.62,-.44,;-4.53,-1.53,;-3.04,-1.13,;-1.95,-2.22,;-.46,-1.82,;-.86,-3.31,;1.02,-1.42,;2.64,-.4,;3.73,.69,;5.22,.29,;5.62,-1.2,;4.53,-2.29,;3.04,-1.89,;1.95,-2.98,;2.35,-4.47,;.46,-2.58,;.86,-4.07,)| Show InChI InChI=1S/C22H20F3N3O2/c1-4-28-18-13-9-10-27-11-15(13)30-21(2,3)17(18)16(19(28)20(26)29)12-7-5-6-8-14(12)22(23,24)25/h5-11H,4H2,1-3H3,(H2,26,29)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	233	n/a	n/a	n/a	n/a	n/a	n/a
FUNDACIÓN DEL SECTOR PÚBLICO ESTATAL CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS CARLOS III (F.S.P. CNIO) US Patent					Assay Description The kinase assay relies on ADP-GloKM biochemical kinase assay (Promega). This is a luminescent kinase assay that measures ADP formed from a kinase re...				US Patent US10208056 (2019) BindingDB Entry DOI: 10.7270/Q2GB266B
					More data for this Ligand-Target Pair