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SMILES: C1CCN(C1)c1cc(-c2ccncc2)c(nn1)-c1ccc2ccccc2c1

InChI Key: InChIKey=ONTJUROYWGHGGB-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50537608   

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
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50537608 (CHEMBL4639995 | US11149020, Compound 32 (MW-148)) Show SMILES C1CCN(C1)c1cc(-c2ccncc2)c(nn1)-c1ccc2ccccc2c1 Show InChI InChI=1S/C23H20N4/c1-2-6-19-15-20(8-7-17(19)5-1)23-21(18-9-11-24-12-10-18)16-22(25-26-23)27-13-3-4-14-27/h1-2,5-12,15-16H,3-4,13-14H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	185	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The concentration dependent ability of compounds to inhibit human p38α MAPK, p38β MAPK and CK-1δ were done essentially as described in...				Citation and Details BindingDB Entry DOI: 10.7270/Q2251NBP
					More data for this Ligand-Target Pair
Casein kinase I isoform delta (Homo sapiens (Human))	BDBM50537608 (CHEMBL4639995 | US11149020, Compound 32 (MW-148)) Show SMILES C1CCN(C1)c1cc(-c2ccncc2)c(nn1)-c1ccc2ccccc2c1 Show InChI InChI=1S/C23H20N4/c1-2-6-19-15-20(8-7-17(19)5-1)23-21(18-9-11-24-12-10-18)16-22(25-26-23)27-13-3-4-14-27/h1-2,5-12,15-16H,3-4,13-14H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.99E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The concentration dependent ability of compounds to inhibit human p38α MAPK, p38β MAPK and CK-1δ were done essentially as described in...				Citation and Details BindingDB Entry DOI: 10.7270/Q2251NBP
					More data for this Ligand-Target Pair
Casein kinase I isoform delta (Homo sapiens (Human))	BDBM50537608 (CHEMBL4639995 | US11149020, Compound 32 (MW-148)) Show SMILES C1CCN(C1)c1cc(-c2ccncc2)c(nn1)-c1ccc2ccccc2c1 Show InChI InChI=1S/C23H20N4/c1-2-6-19-15-20(8-7-17(19)5-1)23-21(18-9-11-24-12-10-18)16-22(25-26-23)27-13-3-4-14-27/h1-2,5-12,15-16H,3-4,13-14H2	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.19E+3	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Concentration required to inhibit the phosphorylation of a 14-residue fragment of phospholipase C gamma 1 by Epidermal growth factor receptor from A4...				J Med Chem 62: 5298-5311 (2019) Article DOI: 10.1021/acs.jmedchem.9b00058 BindingDB Entry DOI: 10.7270/Q24170ZD
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 11 (Homo sapiens (Human))	BDBM50537608 (CHEMBL4639995 | US11149020, Compound 32 (MW-148)) Show SMILES C1CCN(C1)c1cc(-c2ccncc2)c(nn1)-c1ccc2ccccc2c1 Show InChI InChI=1S/C23H20N4/c1-2-6-19-15-20(8-7-17(19)5-1)23-21(18-9-11-24-12-10-18)16-22(25-26-23)27-13-3-4-14-27/h1-2,5-12,15-16H,3-4,13-14H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.19E+3	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Inhibitory activity against HIV-1 Mutant Reverse transcriptase K103N				J Med Chem 62: 5298-5311 (2019) Article DOI: 10.1021/acs.jmedchem.9b00058 BindingDB Entry DOI: 10.7270/Q24170ZD
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50537608 (CHEMBL4639995 | US11149020, Compound 32 (MW-148)) Show SMILES C1CCN(C1)c1cc(-c2ccncc2)c(nn1)-c1ccc2ccccc2c1 Show InChI InChI=1S/C23H20N4/c1-2-6-19-15-20(8-7-17(19)5-1)23-21(18-9-11-24-12-10-18)16-22(25-26-23)27-13-3-4-14-27/h1-2,5-12,15-16H,3-4,13-14H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Northwestern University Curated by ChEMBL					Assay Description Inhibitory activity against HIV-1 Y181C reverse transcriptase.				J Med Chem 62: 5298-5311 (2019) Article DOI: 10.1021/acs.jmedchem.9b00058 BindingDB Entry DOI: 10.7270/Q24170ZD
					More data for this Ligand-Target Pair