Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 289.3 BDBM50275499

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 18 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of GST-fused p38alpha (unknown origin) expressed in Escherichia coli				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of GSK3beta (unknown origin)				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
RAF proto-oncogene serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of c-Raf (unknown origin)				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of EGFR (unknown origin)				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-4 (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of ERBB4 (unknown origin)				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
Angiopoietin-1 receptor (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of TIE2 (unknown origin)				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of VEGFR2 (unknown origin)				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of ERBB2 (unknown origin)				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
Macrophage colony-stimulating factor 1 receptor (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of C-FMS (unknown origin)				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 2 (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of CDK2/CyclinA (unknown origin)				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
RAC-gamma serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of AKT3 (unknown origin)				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 4, mitochondrial (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of PDHK4 (unknown origin)				Bioorg Med Chem Lett 18: 5428-30 (2008) Article DOI: 10.1016/j.bmcl.2008.09.040 BindingDB Entry DOI: 10.7270/Q27S7NM9
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	8.90E+3	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00099 BindingDB Entry DOI: 10.7270/Q23200WW
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	6.05E+3	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00099 BindingDB Entry DOI: 10.7270/Q23200WW
					More data for this Ligand-Target Pair
Adenosine receptor A2b (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00099 BindingDB Entry DOI: 10.7270/Q23200WW
					More data for this Ligand-Target Pair
Adenosine receptor A2b (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00099 BindingDB Entry DOI: 10.7270/Q23200WW
					More data for this Ligand-Target Pair
Adenosine receptor A2b (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00099 BindingDB Entry DOI: 10.7270/Q23200WW
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50275499 (2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo-[1,5-a]...) Show SMILES Fc1ccc(cc1)-c1nn2ccccc2c1-c1ccncc1 Show InChI InChI=1S/C18H12FN3/c19-15-6-4-14(5-7-15)18-17(13-8-10-20-11-9-13)16-3-1-2-12-22(16)21-18/h1-12H	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	740	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.2c00099 BindingDB Entry DOI: 10.7270/Q23200WW
					More data for this Ligand-Target Pair