BDBM311124 US10155751, Example 11

SMILES: C[C@@H](Oc1cc(cc2nn(C)c(C)c12)-c1cnn(CCF)c1)[C@H]1CNC(=O)C1

InChI Key: InChIKey=QWHVOXVCFNCJAQ-UKRRQHHQSA-N

Data: 3 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 3 hits for monomerid = 311124   

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
Tyrosine-protein kinase SYK [342-635] (Homo sapiens (Human))	BDBM311124 (US10155751, Example 11) Show SMILES C[C@@H](Oc1cc(cc2nn(C)c(C)c12)-c1cnn(CCF)c1)[C@H]1CNC(=O)C1 |r| Show InChI InChI=1S/C20H24FN5O2/c1-12-20-17(24-25(12)3)6-14(16-10-23-26(11-16)5-4-21)7-18(20)28-13(2)15-8-19(27)22-9-15/h6-7,10-11,13,15H,4-5,8-9H2,1-3H3,(H,22,27)/t13-,15-/m1/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description Recombinant human SYK (amino acids 342-635) was expressed as a fusion protein with an N-terminal GST tag. The test compounds were dissolved in 100% D...				US Patent US10155751 (2018) BindingDB Entry DOI: 10.7270/Q2PK0J60
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 [564-960] (Homo sapiens (Human))	BDBM311124 (US10155751, Example 11) Show SMILES C[C@@H](Oc1cc(cc2nn(C)c(C)c12)-c1cnn(CCF)c1)[C@H]1CNC(=O)C1 |r| Show InChI InChI=1S/C20H24FN5O2/c1-12-20-17(24-25(12)3)6-14(16-10-23-26(11-16)5-4-21)7-18(20)28-13(2)15-8-19(27)22-9-15/h6-7,10-11,13,15H,4-5,8-9H2,1-3H3,(H,22,27)/t13-,15-/m1/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description Recombinant human FLT3 (amino acids 564-958, Molecular weight 48.6 kDa, Invitrogen #PR4666C) was expressed with an Histidine tag. The test compounds...				US Patent US10155751 (2018) BindingDB Entry DOI: 10.7270/Q2PK0J60
					More data for this Ligand-Target Pair
Aurora kinase B [1-341] (Homo sapiens (Human))	BDBM311124 (US10155751, Example 11) Show SMILES C[C@@H](Oc1cc(cc2nn(C)c(C)c12)-c1cnn(CCF)c1)[C@H]1CNC(=O)C1 |r| Show InChI InChI=1S/C20H24FN5O2/c1-12-20-17(24-25(12)3)6-14(16-10-23-26(11-16)5-4-21)7-18(20)28-13(2)15-8-19(27)22-9-15/h6-7,10-11,13,15H,4-5,8-9H2,1-3H3,(H,22,27)/t13-,15-/m1/s1	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description Recombinant human Aurora B (amino acids 1-344, clone number DU1773, Molecular weight 40.2 kDa, University of Dundee) was expressed as a fusion protei...				US Patent US10155751 (2018) BindingDB Entry DOI: 10.7270/Q2PK0J60
					More data for this Ligand-Target Pair