Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | P2RY1 | P47900 | 3/20 | 0.32 |
| ▸ | PPIA | P62937 | 2/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | PPIF | P30405 | 1/20 | 0.32 |
| ▸ | GHSR | Q92847 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8997699 | 0.92 | CA1 (0.36) | NPC1RAB9AALDH1A1CA1CA2 | |
| SCHEMBL8997628 | 0.88 | CA1 (0.34) | RAB9AALDH1A1CA1CA2ACHE | |
| SCHEMBL8997810 | 0.84 | P2RY1 (0.39) | P2RY1KDM4E | |
| SCHEMBL8997648 | 0.83 | SYK (0.38) | CA1CA2ACHESYKGHSR | |
| SCHEMBL8580922 | 0.82 | MEN1 (0.44) | MEN1KMT2ANPC1RAB9AATM | |
| SCHEMBL8997804 | 0.81 | P2RY1 (0.37) | ALDH1A1P2RY1SYKKDM4ECYP3A4 | |
| SCHEMBL8561422 | 0.79 | CTSV (0.36) | MEN1KMT2ANPC1RAB9AALDH1A1 | |
| SCHEMBL8561322 | 0.79 | SYK (0.40) | CA1CA2ACHESYKGHSR | |
| SCHEMBL8575729 | 0.79 | CA1 (0.39) | MEN1KMT2AALDH1A1CA1CA2 | |
| SCHEMBL8567143 | 0.79 | CA1 (0.39) | MEN1KMT2AALDH1A1CA1CA2 |
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-0729972-A1 | Peptide derivatives of tetrahydronaphthalene | F. HOFFMANN-LA ROCHE AG (CH) | 1996-09-04 | — | — | EP | disclosed |