BDBM50074705 CHEMBL359934::Phosphoric acid mono-[4-((5S,8R,11S,14R,17R,23aR)-17-acetylamino-8-carbamoylmethyl-5,11-diisopropyl-4,7,10,13,16,23-hexaoxo-docosahydro-3a,6,9,12,15,22-hexaaza-cyclopentacyclodocosen-14-ylmethyl)-phenyl] ester
SMILES: CC(C)[C@@H]1NC(=O)[C@@H](Cc2ccc(OP(O)(O)=O)cc2)NC(=O)[C@@H](CCCCNC(=O)[C@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](CC(N)=O)NC1=O)C(C)C)NC(C)=O
InChI Key: InChIKey=ZFXYMDBTOLQWLR-WOMNCXHOSA-N
Data: 2 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Grb2-SH2 (Homo sapiens (Human)) | BDBM50074705 (CHEMBL359934 | Phosphoric acid mono-[4-((5S,8R,11S...) | 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 | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Forschungsinstitut Curated by ChEMBL | Assay Description Inhibitory activity against binding of Growth factor receptor bound protein 2 to biotinylated KPFY*VNVEF Peptide by ELISA. | J Med Chem 42: 971-80 (1999) Article DOI: 10.1021/jm9811007 BindingDB Entry DOI: 10.7270/Q28S4P35 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human)) | BDBM50074705 (CHEMBL359934 | Phosphoric acid mono-[4-((5S,8R,11S...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 7.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Forschungsinstitut Curated by ChEMBL | Assay Description Inhibitory activity against binding of Src protein tryrosine kinase SH2 domain to biotinylated EPQY*EEIPI Peptide by ELISA. | J Med Chem 42: 971-80 (1999) Article DOI: 10.1021/jm9811007 BindingDB Entry DOI: 10.7270/Q28S4P35 | |||||||||||
More data for this Ligand-Target Pair |