Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL441786 | 0.81 | ALDH1A1 (0.37) | MMP8PKMKDM4EALDH1A1THRB | |
| SCHEMBL12482713 | 0.78 | MMP8 (0.35) | MMP8PKMKDM4EALDH1A1THRB | |
| SCHEMBL17801525 | 0.78 | SYK (0.41) | MMP8PKMKDM4EALDH1A1THRB | |
| SCHEMBL892045 | 0.76 | MMP8 (0.41) | MMP8PKMKDM4EALDH1A1THRB | |
| SCHEMBL7427206 | 0.75 | SYK (0.50) | MMP8ALDH1A1RECQLLMNAMAPT | |
| SCHEMBL16492775 | 0.73 | MMP8 (0.41) | MMP8PKMKDM4EALDH1A1RECQL | |
| SCHEMBL14504422 | 0.72 | MMP8 (0.43) | MMP8PKMKDM4EALDH1A1THRB | |
| SCHEMBL954289 | 0.72 | MMP8 (0.43) | MMP8PKMKDM4EALDH1A1THRB | |
| SCHEMBL1682735 | 0.72 | CYP4F2 (0.41) | MMP8PKMKDM4EALDH1A1RECQL | |
| SCHEMBL8863698 | 0.72 | MAPT (0.43) | LMNAMAPTMEN1KMT2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3227279-B1 | 1-OXO-1,2-DIHYDROISOQUINOLIN-7-YL-(5-SUBSTITUTED-THIOPHEN-2-YL)-SULFONAMIDE COMPOUNDS, FORMULATIONS CONTAINING THOSE COMPOUNDS, AND THEIR USE AS AICARFT INHIBITORS IN THE TREATMENT OF CANCERS | LILLY CO ELI (US) | 2019-02-13 | — | — | EP | disclosed |