BDBM50320222 CHEMBL1085564::phenyl4-(7-amino-3-(3-(4-methylpiperazin-1-yl)phenyl)pyrazolo[1,5-a]pyrimidin-6-yl)phenylcarbamate

SMILES: CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)Oc2ccccc2)cc1

InChI Key: InChIKey=RNRCLARSVNONBS-UHFFFAOYSA-N

Data: 5 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 = 50320222   

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
Tyrosine-protein kinase Lck (Homo sapiens (Human))	BDBM50320222 (CHEMBL1085564 | phenyl4-(7-amino-3-(3-(4-methylpip...) Show SMILES CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)Oc2ccccc2)cc1 Show InChI InChI=1S/C30H29N7O2/c1-35-14-16-36(17-15-35)24-7-5-6-22(18-24)27-20-33-37-28(31)26(19-32-29(27)37)21-10-12-23(13-11-21)34-30(38)39-25-8-3-2-4-9-25/h2-13,18-20H,14-17,31H2,1H3,(H,34,38)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute of Biomedical Research Curated by ChEMBL					Assay Description Inhibition of LCK				Bioorg Med Chem Lett 20: 3628-31 (2010) Article DOI: 10.1016/j.bmcl.2010.04.112 BindingDB Entry DOI: 10.7270/Q2XP754D
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50320222 (CHEMBL1085564 | phenyl4-(7-amino-3-(3-(4-methylpip...) Show SMILES CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)Oc2ccccc2)cc1 Show InChI InChI=1S/C30H29N7O2/c1-35-14-16-36(17-15-35)24-7-5-6-22(18-24)27-20-33-37-28(31)26(19-32-29(27)37)21-10-12-23(13-11-21)34-30(38)39-25-8-3-2-4-9-25/h2-13,18-20H,14-17,31H2,1H3,(H,34,38)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	688	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute of Biomedical Research Curated by ChEMBL					Assay Description Inhibition of SRC				Bioorg Med Chem Lett 20: 3628-31 (2010) Article DOI: 10.1016/j.bmcl.2010.04.112 BindingDB Entry DOI: 10.7270/Q2XP754D
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Lck (Homo sapiens (Human))	BDBM50320222 (CHEMBL1085564 | phenyl4-(7-amino-3-(3-(4-methylpip...) Show SMILES CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)Oc2ccccc2)cc1 Show InChI InChI=1S/C30H29N7O2/c1-35-14-16-36(17-15-35)24-7-5-6-22(18-24)27-20-33-37-28(31)26(19-32-29(27)37)21-10-12-23(13-11-21)34-30(38)39-25-8-3-2-4-9-25/h2-13,18-20H,14-17,31H2,1H3,(H,34,38)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute of Biomedical Research Curated by ChEMBL					Assay Description Inhibition of LCK in human Jurkat cells assessed as ZAP70 phosphorylation by FACS assay				Bioorg Med Chem Lett 20: 3628-31 (2010) Article DOI: 10.1016/j.bmcl.2010.04.112 BindingDB Entry DOI: 10.7270/Q2XP754D
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50320222 (CHEMBL1085564 | phenyl4-(7-amino-3-(3-(4-methylpip...) Show SMILES CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)Oc2ccccc2)cc1 Show InChI InChI=1S/C30H29N7O2/c1-35-14-16-36(17-15-35)24-7-5-6-22(18-24)27-20-33-37-28(31)26(19-32-29(27)37)21-10-12-23(13-11-21)34-30(38)39-25-8-3-2-4-9-25/h2-13,18-20H,14-17,31H2,1H3,(H,34,38)	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	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute of Biomedical Research Curated by ChEMBL					Assay Description Inhibition of KDR				Bioorg Med Chem Lett 20: 3628-31 (2010) Article DOI: 10.1016/j.bmcl.2010.04.112 BindingDB Entry DOI: 10.7270/Q2XP754D
					More data for this Ligand-Target Pair
Tyrosine-protein kinase HCK (Homo sapiens (Human))	BDBM50320222 (CHEMBL1085564 | phenyl4-(7-amino-3-(3-(4-methylpip...) Show SMILES CN1CCN(CC1)c1cccc(c1)-c1cnn2c(N)c(cnc12)-c1ccc(NC(=O)Oc2ccccc2)cc1 Show InChI InChI=1S/C30H29N7O2/c1-35-14-16-36(17-15-35)24-7-5-6-22(18-24)27-20-33-37-28(31)26(19-32-29(27)37)21-10-12-23(13-11-21)34-30(38)39-25-8-3-2-4-9-25/h2-13,18-20H,14-17,31H2,1H3,(H,34,38)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	193	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute of Biomedical Research Curated by ChEMBL					Assay Description Inhibition of HCK				Bioorg Med Chem Lett 20: 3628-31 (2010) Article DOI: 10.1016/j.bmcl.2010.04.112 BindingDB Entry DOI: 10.7270/Q2XP754D
					More data for this Ligand-Target Pair