BDBM315934 US10172859, Example 358::US9732094, Example 358::[2,4-Difluoro-5-(7- morpholin-4-yl- quinazolin-4-yl)- phenyl]pyrrolo[1,2-a] pyrazin-1-ylmethanol1H NMR (500 MHz, DMSO-d6) ppm = 9.12 (s,1H), 8.25-8.19 (m, 1H), 7.94 (t, J = 8.2, 1H), 7.78(dd, J = 2.5, 1.3, 1H), 7.58 (dd, J = 9.3, 3.0, 1H),7.55 (dd, J = 9.4, 2.4, 1H), 7.47-7.39 (m, 2H),7.22 (d, J = 2.3, 1H), 6.97-6.93 (m, 1H), 6.91 (dd,J = 4.1, 2.5, 1H), 6.43 (d, J = 5.9, 1H), 6.30 (d,J = 5.9, 1H), 3.82-3.76 (m, 4H), 3.49-3.44 (m,4H).

SMILES: OC(c1cc(c(F)cc1F)-c1ncnc2cc(ccc12)N1CCOCC1)c1nccn2cccc12

InChI Key: InChIKey=WWULIMQUQVVHHC-UHFFFAOYSA-N

Data: 2 KI  2 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 5 hits for monomerid = 315934   

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
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM315934 (US10172859, Example 358 | US11065253, Example 358 ...) Show SMILES OC(c1cc(c(F)cc1F)-c1ncnc2cc(ccc12)N1CCOCC1)c1nccn2cccc12 Show InChI InChI=1S/C26H21F2N5O2/c27-20-14-21(28)19(26(34)25-23-2-1-6-33(23)7-5-29-25)13-18(20)24-17-4-3-16(12-22(17)30-15-31-24)32-8-10-35-11-9-32/h1-7,12-15,26,34H,8-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Patent GmbH US Patent					Assay Description The patch-clamp measurement was carried out at room temperature in whole-cell configuration on human embryonic kidney cells (HEK293) which have been ...				US Patent US9732094 (2017) BindingDB Entry DOI: 10.7270/Q2J67K1S
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM315934 (US10172859, Example 358 | US11065253, Example 358 ...) Show SMILES OC(c1cc(c(F)cc1F)-c1ncnc2cc(ccc12)N1CCOCC1)c1nccn2cccc12 Show InChI InChI=1S/C26H21F2N5O2/c27-20-14-21(28)19(26(34)25-23-2-1-6-33(23)7-5-29-25)13-18(20)24-17-4-3-16(12-22(17)30-15-31-24)32-8-10-35-11-9-32/h1-7,12-15,26,34H,8-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Patent GmbH US Patent					Assay Description Method for the detection and characterisation of test substances which interfere with the Kv11.1 (hERG) channel: Kv11.1 (hERG, human ether a-go-go re...				US Patent US10172859 (2019) BindingDB Entry DOI: 10.7270/Q23B626S
					More data for this Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit (Homo sapiens (Human))	BDBM315934 (US10172859, Example 358 | US11065253, Example 358 ...) Show SMILES OC(c1cc(c(F)cc1F)-c1ncnc2cc(ccc12)N1CCOCC1)c1nccn2cccc12 Show InChI InChI=1S/C26H21F2N5O2/c27-20-14-21(28)19(26(34)25-23-2-1-6-33(23)7-5-29-25)13-18(20)24-17-4-3-16(12-22(17)30-15-31-24)32-8-10-35-11-9-32/h1-7,12-15,26,34H,8-11H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit (Homo sapiens (Human))	BDBM315934 (US10172859, Example 358 | US11065253, Example 358 ...) Show SMILES OC(c1cc(c(F)cc1F)-c1ncnc2cc(ccc12)N1CCOCC1)c1nccn2cccc12 Show InChI InChI=1S/C26H21F2N5O2/c27-20-14-21(28)19(26(34)25-23-2-1-6-33(23)7-5-29-25)13-18(20)24-17-4-3-16(12-22(17)30-15-31-24)32-8-10-35-11-9-32/h1-7,12-15,26,34H,8-11H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Patent GmbH US Patent					Assay Description The kinase assay was carried out in streptavidin-coated 348-well microtitre flashplates. To this end, 1.5 μg of DNA-PK/protein complex and 100 n...				US Patent US10172859 (2019) BindingDB Entry DOI: 10.7270/Q23B626S
					More data for this Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit (Homo sapiens (Human))	BDBM315934 (US10172859, Example 358 | US11065253, Example 358 ...) Show SMILES OC(c1cc(c(F)cc1F)-c1ncnc2cc(ccc12)N1CCOCC1)c1nccn2cccc12 Show InChI InChI=1S/C26H21F2N5O2/c27-20-14-21(28)19(26(34)25-23-2-1-6-33(23)7-5-29-25)13-18(20)24-17-4-3-16(12-22(17)30-15-31-24)32-8-10-35-11-9-32/h1-7,12-15,26,34H,8-11H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Patent GmbH US Patent					Assay Description The kinase assay was carried out in streptavidin-coated 348-well microtitre flashplates. To this end, 1.5 ug of DNA-PK/protein complex and 100 ng of ...				US Patent US9732094 (2017) BindingDB Entry DOI: 10.7270/Q2J67K1S
					More data for this Ligand-Target Pair