Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MYC | P01106 | 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 | |
|---|---|---|---|---|
| SCHEMBL27799486 | 0.85 | MEN1 (0.38) | CYP3A4MAPTMEN1LMNAHTT | |
| SCHEMBL6829176 | 0.79 | KDM4E (0.35) | CYP3A4MAPTMEN1KMT2ALMNA | |
| Hydrochloric Acid SCHEMBL17675148 | 0.78 | EDNRB (0.35) | MEN1KMT2AALDH1A1 | |
| SCHEMBL1325109 | 0.73 | THRB (0.38) | MAPTLMNATHRBTDP1 | |
| SCHEMBL6830859 | 0.72 | LMNA (0.40) | CYP3A4MAPTMEN1KMT2AHSD11B1 | |
| SCHEMBL4708203 | 0.72 | HTR2A (0.34) | KMT2A | |
| SCHEMBL4758940 | 0.72 | MTNR1A (0.33) | KMT2A | |
| SCHEMBL29715005 | 0.72 | MAPT (0.53) | CYP3A4MAPTTHRBTDP1KDM4E | |
| SCHEMBL18986930 | 0.70 | THRB (0.36) | MAPTLMNATHRBTDP1 | |
| SCHEMBL3696570 | 0.70 | ALDH1A1 (0.44) | CYP3A4MAPTLMNATHRBTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004096774-A1 | ACYL ISOINDOLINE DERIVATIVES AND ACYL ISOQUINOLINE DERIVATIVES AS ANTI-VIRAL AGENTS | GLAXO GROUP LIMITED (GB) | 2004-11-11 | — | — | WO | disclosed |