BDBM356342 US10604535, Example 100A::US9815850, Compound 100A::US9896458, No. 100A

SMILES: CN1c2ncccc2[C@@H]2C[C@@H]2[C@H](NC(=O)c2cc(Oc3ccccc3F)ccn2)C1=O

InChI Key: InChIKey=MSDXAABDMCXHGO-FTRWYGJKSA-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 = 356342   

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
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM356342 (US10604535, Example 100A | US9815850, Compound 100...) Show SMILES CN1c2ncccc2[C@@H]2C[C@@H]2[C@H](NC(=O)c2cc(Oc3ccccc3F)ccn2)C1=O |r| Show InChI InChI=1S/C23H19FN4O3/c1-28-21-14(5-4-9-26-21)15-12-16(15)20(23(28)30)27-22(29)18-11-13(8-10-25-18)31-19-7-3-2-6-17(19)24/h2-11,15-16,20H,12H2,1H3,(H,27,29)/t15-,16-,20-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
University of Mississippi					Assay Description Test compounds were diluted in DMSO and 0.1 μL of solution was dispensed to each well of a 384-well white solid microplate. The assay buffer was...				J Med Chem 48: 2906-15 (2005) BindingDB Entry DOI: 10.7270/Q2XW4N44
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM356342 (US10604535, Example 100A | US9815850, Compound 100...) Show SMILES CN1c2ncccc2[C@@H]2C[C@@H]2[C@H](NC(=O)c2cc(Oc3ccccc3F)ccn2)C1=O |r| Show InChI InChI=1S/C23H19FN4O3/c1-28-21-14(5-4-9-26-21)15-12-16(15)20(23(28)30)27-22(29)18-11-13(8-10-25-18)31-19-7-3-2-6-17(19)24/h2-11,15-16,20H,12H2,1H3,(H,27,29)/t15-,16-,20-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Denali Therapeutics Inc. US Patent					Assay Description Fluorescent polarization binding assay was performed in polystyrene low volume 384-well black plate, at Room Temperature (RT) in a final volume of 10...				US Patent US10604535 (2020)
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM356342 (US10604535, Example 100A | US9815850, Compound 100...) Show SMILES CN1c2ncccc2[C@@H]2C[C@@H]2[C@H](NC(=O)c2cc(Oc3ccccc3F)ccn2)C1=O |r| Show InChI InChI=1S/C23H19FN4O3/c1-28-21-14(5-4-9-26-21)15-12-16(15)20(23(28)30)27-22(29)18-11-13(8-10-25-18)31-19-7-3-2-6-17(19)24/h2-11,15-16,20H,12H2,1H3,(H,27,29)/t15-,16-,20-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Denali Therapeutics Inc. US Patent					Assay Description Assay was performed in polystyrene low volume 384-well black plate, at Room Temperature (RT) in a final volume of 10.1 μl/well using 10 nM of GS...				US Patent US9815850 (2017) BindingDB Entry DOI: 10.7270/Q2W0987J
					More data for this Ligand-Target Pair