Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.53 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA4 | P22748 | 1/20 | 0.49 |
| ▸ | CA5A | P35218 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11124721 | 0.85 | EPHX1 (0.53) | EPHX1EPHX2GAACYP3A4SLC2A1 | |
| SCHEMBL10521499 | 0.80 | EPHX1 (0.58) | EPHX1EPHX2GAACYP3A4SLC2A1 | |
| SCHEMBL29331891 | 0.79 | EPHX1 (0.61) | EPHX1EPHX2GAACYP3A4SLC2A1 | |
| SCHEMBL23764787 | 0.76 | ALDH1A1 (0.50) | GAACA2CA9ALDH1A1KMT2A | |
| SCHEMBL1461879 | 0.74 | CYP3A4 (0.65) | EPHX1EPHX2GAACYP3A4SLC2A1 | |
| Hydrochloric Acid SCHEMBL27622843 | 0.74 | SLC6A2 (0.50) | EPHX1EPHX2NPSR1HSD17B10KMT2A | |
| SCHEMBL10687685 | 0.74 | APEX1 (0.55) | EPHX1EPHX2GAACYP3A4SLC2A1 | |
| SCHEMBL22529434 | 0.72 | L3MBTL1 (0.67) | EPHX1EPHX2GAACYP3A4SLC2A1 | |
| SCHEMBL11435881 | 0.71 | EPHX1 (0.47) | EPHX1EPHX2GAACYP3A4CA2 | |
| SCHEMBL29352610 | 0.71 | EPHX1 (0.70) | EPHX1EPHX2GAACYP3A4SLC2A1 |
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-2009119528-A1 | HETEROCYCLIC COMPOUND | 武田薬品工業株式会社 (JP) | 2009-10-01 | — | — | WO | disclosed |