BDBM292485 (S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidin-1-yl)-6-(5-(thiophen-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl)isonicotinamide::US10100058, Example 141

SMILES: CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC

InChI Key: InChIKey=UCHOYOABTVPSLZ-SFHVURJKSA-N

Data: 8 IC50  3 EC50

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 11 hits for monomerid = 292485   

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
Calcium/calmodulin-dependent protein kinase type II subunit delta (Homo sapiens (Human))	BDBM292485 ((S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidi...) Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC |r| Show InChI InChI=1S/C27H33N7O2S/c1-5-32(6-2)18(3)14-28-27(35)19-12-23(30-25(13-19)33-16-20(17-33)36-4)21-15-29-34-10-9-22(31-26(21)34)24-8-7-11-37-24/h7-13,15,18,20H,5-6,14,16-17H2,1-4H3,(H,28,35)/t18-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.100	n/a	n/a	n/a	n/a	n/a	n/a
Gilead Sciences, Inc. US Patent					Assay Description The biochemical activity of recombinant CaMKIIδ was measured by monitoring the phosphorylation of a target peptide using Homogenous Time Resolve...				US Patent US10100058 (2018) BindingDB Entry DOI: 10.7270/Q2V98B4F
					More data for this Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta (Homo sapiens (Human))	BDBM292485 ((S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidi...) Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC |r| Show InChI InChI=1S/C27H33N7O2S/c1-5-32(6-2)18(3)14-28-27(35)19-12-23(30-25(13-19)33-16-20(17-33)36-4)21-15-29-34-10-9-22(31-26(21)34)24-8-7-11-37-24/h7-13,15,18,20H,5-6,14,16-17H2,1-4H3,(H,28,35)/t18-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	13.7	n/a	n/a	n/a	n/a
Gilead Sciences, Inc. US Patent					Assay Description CaMKII activity in neonatal rat ventricular myocytes (NRVM) was measured by monitoring the phosphorylation level of phospholamban using high-content ...				US Patent US10100058 (2018) BindingDB Entry DOI: 10.7270/Q2V98B4F
					More data for this Ligand-Target Pair
Cytochrome P450 2C19 (Homo sapiens (Human))	BDBM292485 ((S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidi...) Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC |r| Show InChI InChI=1S/C27H33N7O2S/c1-5-32(6-2)18(3)14-28-27(35)19-12-23(30-25(13-19)33-16-20(17-33)36-4)21-15-29-34-10-9-22(31-26(21)34)24-8-7-11-37-24/h7-13,15,18,20H,5-6,14,16-17H2,1-4H3,(H,28,35)/t18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of CYP2C19 (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2017.10.040 BindingDB Entry DOI: 10.7270/Q2930WR2
					More data for this Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta (Homo sapiens (Human))	BDBM292485 ((S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidi...) Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC |r| Show InChI InChI=1S/C27H33N7O2S/c1-5-32(6-2)18(3)14-28-27(35)19-12-23(30-25(13-19)33-16-20(17-33)36-4)21-15-29-34-10-9-22(31-26(21)34)24-8-7-11-37-24/h7-13,15,18,20H,5-6,14,16-17H2,1-4H3,(H,28,35)/t18-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	0.100	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human full length His-tagged CaMK2delta expressed in baculovirus using Biotin labelled STK1 as substrate after 1 hr in pres...				Citation and Details Article DOI: 10.1016/j.bmcl.2017.10.040 BindingDB Entry DOI: 10.7270/Q2930WR2
					More data for this Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit alpha/beta (Rattus norvegicus (rat))	BDBM292485 ((S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidi...) Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC |r| Show InChI InChI=1S/C27H33N7O2S/c1-5-32(6-2)18(3)14-28-27(35)19-12-23(30-25(13-19)33-16-20(17-33)36-4)21-15-29-34-10-9-22(31-26(21)34)24-8-7-11-37-24/h7-13,15,18,20H,5-6,14,16-17H2,1-4H3,(H,28,35)/t18-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	n/a	n/a	120	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of CaMK2alpha/beta in neonatal rat cortical neurons assessed as phospholamban phosphorylation after 4 hrs by Hoechst 33342 fluorescence-ba...				Citation and Details Article DOI: 10.1016/j.bmcl.2017.10.040 BindingDB Entry DOI: 10.7270/Q2930WR2
					More data for this Ligand-Target Pair
1,3-beta-glucan synthase component GSC2 (Saccharomyces cerevisiae)	BDBM292485 ((S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidi...) Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC |r| Show InChI InChI=1S/C27H33N7O2S/c1-5-32(6-2)18(3)14-28-27(35)19-12-23(30-25(13-19)33-16-20(17-33)36-4)21-15-29-34-10-9-22(31-26(21)34)24-8-7-11-37-24/h7-13,15,18,20H,5-6,14,16-17H2,1-4H3,(H,28,35)/t18-/m0/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	4.16E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2017.10.040 BindingDB Entry DOI: 10.7270/Q2930WR2
					More data for this Ligand-Target Pair
Cytochrome P450 2C9 (Homo sapiens (Human))	BDBM292485 ((S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidi...) Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC |r| Show InChI InChI=1S/C27H33N7O2S/c1-5-32(6-2)18(3)14-28-27(35)19-12-23(30-25(13-19)33-16-20(17-33)36-4)21-15-29-34-10-9-22(31-26(21)34)24-8-7-11-37-24/h7-13,15,18,20H,5-6,14,16-17H2,1-4H3,(H,28,35)/t18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of CYP2C9 (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2017.10.040 BindingDB Entry DOI: 10.7270/Q2930WR2
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM292485 ((S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidi...) Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC |r| Show InChI InChI=1S/C27H33N7O2S/c1-5-32(6-2)18(3)14-28-27(35)19-12-23(30-25(13-19)33-16-20(17-33)36-4)21-15-29-34-10-9-22(31-26(21)34)24-8-7-11-37-24/h7-13,15,18,20H,5-6,14,16-17H2,1-4H3,(H,28,35)/t18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of CYP3A4 (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2017.10.040 BindingDB Entry DOI: 10.7270/Q2930WR2
					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM292485 ((S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidi...) Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC |r| Show InChI InChI=1S/C27H33N7O2S/c1-5-32(6-2)18(3)14-28-27(35)19-12-23(30-25(13-19)33-16-20(17-33)36-4)21-15-29-34-10-9-22(31-26(21)34)24-8-7-11-37-24/h7-13,15,18,20H,5-6,14,16-17H2,1-4H3,(H,28,35)/t18-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of CYP2D6 (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2017.10.040 BindingDB Entry DOI: 10.7270/Q2930WR2
					More data for this Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit gamma (Rattus norvegicus)	BDBM292485 ((S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidi...) Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC |r| Show InChI InChI=1S/C27H33N7O2S/c1-5-32(6-2)18(3)14-28-27(35)19-12-23(30-25(13-19)33-16-20(17-33)36-4)21-15-29-34-10-9-22(31-26(21)34)24-8-7-11-37-24/h7-13,15,18,20H,5-6,14,16-17H2,1-4H3,(H,28,35)/t18-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	n/a	n/a	7.40	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of CaMK2gamma/delta in neonatal rat ventricular myocytes assessed as phospholamban phosphorylation after 4 hrs by Hoechst 33342 fluorescen...				Citation and Details Article DOI: 10.1016/j.bmcl.2017.10.040 BindingDB Entry DOI: 10.7270/Q2930WR2
					More data for this Ligand-Target Pair
Cytochrome P450 1A2 (Homo sapiens (Human))	BDBM292485 ((S)-N-(2-(diethylamino)propyl)-2-(3-methoxyazetidi...) Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)OC |r| Show InChI InChI=1S/C27H33N7O2S/c1-5-32(6-2)18(3)14-28-27(35)19-12-23(30-25(13-19)33-16-20(17-33)36-4)21-15-29-34-10-9-22(31-26(21)34)24-8-7-11-37-24/h7-13,15,18,20H,5-6,14,16-17H2,1-4H3,(H,28,35)/t18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of CYP1A2 (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2017.10.040 BindingDB Entry DOI: 10.7270/Q2930WR2
					More data for this Ligand-Target Pair