BDBM50240980 CHEMBL372450::N-(3-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)phenyl)-2,3'-bithiophene-5-carboxamide::[2,3']Bithiophenyl-5-carboxylic acid [3-(4-oxo-3,4-dihydro-phthalazin-1-ylmethyl)-phenyl]-amide
SMILES: O=C(Nc1cccc(Cc2n[nH]c(=O)c3ccccc23)c1)c1ccc(s1)-c1ccsc1
InChI Key: InChIKey=MFMIZBCYOYSYCP-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human)) | BDBM50240980 (CHEMBL372450 | N-(3-((4-oxo-3,4-dihydrophthalazin-...) | PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
Huazhong University of Science and Technology Curated by ChEMBL | Assay Description Inhibition of human recombinant PARP1 | J Med Chem 52: 718-25 (2009) Article DOI: 10.1021/jm800902t BindingDB Entry DOI: 10.7270/Q2C53KPW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human)) | BDBM50240980 (CHEMBL372450 | N-(3-((4-oxo-3,4-dihydrophthalazin-...) | PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 56 | n/a | n/a | n/a | n/a | n/a | n/a |
KuDOS Horsham Ltd Curated by ChEMBL | Assay Description Inhibitory concentration against human poly (ADP-ribose) polymerase 1 (PARP-1) | Bioorg Med Chem Lett 15: 2235-8 (2005) Article DOI: 10.1016/j.bmcl.2005.03.026 BindingDB Entry DOI: 10.7270/Q2QV3M0B | |||||||||||
More data for this Ligand-Target Pair |