BDBM50318178 CHEMBL1094475::N4-(3-Ethynylphenyl)-6-(2,4-dichlorobenzyl)-7Hpyrrolo[2,3-d]pyrimidine-2,4-diamine

SMILES: Nc1nc(Nc2cccc(c2)C#C)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1

InChI Key: InChIKey=ZCRINIKANCTMRT-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50318178   

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
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50318178 (CHEMBL1094475 | N4-(3-Ethynylphenyl)-6-(2,4-dichlo...) Show SMILES Nc1nc(Nc2cccc(c2)C#C)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1 Show InChI InChI=1S/C21H15Cl2N5/c1-2-12-4-3-5-15(8-12)25-19-17-11-16(26-20(17)28-21(24)27-19)9-13-6-7-14(22)10-18(13)23/h1,3-8,10-11H,9H2,(H4,24,25,26,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.56E+4	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibition of VEGFR2 phosphorylation in human U251 cells after 10 mins by FLISA				Bioorg Med Chem 18: 3575-87 (2010) Article DOI: 10.1016/j.bmc.2010.03.052 BindingDB Entry DOI: 10.7270/Q2V69JRB
					More data for this Ligand-Target Pair
Platelet-derived growth factor receptor beta (Homo sapiens (Human))	BDBM50318178 (CHEMBL1094475 | N4-(3-Ethynylphenyl)-6-(2,4-dichlo...) Show SMILES Nc1nc(Nc2cccc(c2)C#C)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1 Show InChI InChI=1S/C21H15Cl2N5/c1-2-12-4-3-5-15(8-12)25-19-17-11-16(26-20(17)28-21(24)27-19)9-13-6-7-14(22)10-18(13)23/h1,3-8,10-11H,9H2,(H4,24,25,26,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibition of PDGFRbeta phosphorylation in human SF539 cells after 10 mins by FLISA				Bioorg Med Chem 18: 3575-87 (2010) Article DOI: 10.1016/j.bmc.2010.03.052 BindingDB Entry DOI: 10.7270/Q2V69JRB
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 1 (Homo sapiens (Human))	BDBM50318178 (CHEMBL1094475 | N4-(3-Ethynylphenyl)-6-(2,4-dichlo...) Show SMILES Nc1nc(Nc2cccc(c2)C#C)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1 Show InChI InChI=1S/C21H15Cl2N5/c1-2-12-4-3-5-15(8-12)25-19-17-11-16(26-20(17)28-21(24)27-19)9-13-6-7-14(22)10-18(13)23/h1,3-8,10-11H,9H2,(H4,24,25,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibition of VEGFR1 phosphorylation in human A498 cells after 10 mins by FLISA				Bioorg Med Chem 18: 3575-87 (2010) Article DOI: 10.1016/j.bmc.2010.03.052 BindingDB Entry DOI: 10.7270/Q2V69JRB
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50318178 (CHEMBL1094475 | N4-(3-Ethynylphenyl)-6-(2,4-dichlo...) Show SMILES Nc1nc(Nc2cccc(c2)C#C)c2cc(Cc3ccc(Cl)cc3Cl)[nH]c2n1 Show InChI InChI=1S/C21H15Cl2N5/c1-2-12-4-3-5-15(8-12)25-19-17-11-16(26-20(17)28-21(24)27-19)9-13-6-7-14(22)10-18(13)23/h1,3-8,10-11H,9H2,(H4,24,25,26,27,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibition of EGFR phosphorylation in human A431 cells after 10 mins by FLISA				Bioorg Med Chem 18: 3575-87 (2010) Article DOI: 10.1016/j.bmc.2010.03.052 BindingDB Entry DOI: 10.7270/Q2V69JRB
					More data for this Ligand-Target Pair