Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | GHSR | Q92847 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.33 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8997778 | 0.92 | MEN1 (0.40) | CA1CA2ACHESYKGHSR | |
| SCHEMBL8997648 | 0.87 | SYK (0.38) | CA1CA2ACHESYKGHSR | |
| SCHEMBL8561422 | 0.83 | CTSV (0.36) | CA1CA2ACHEALDH1A1HTT | |
| SCHEMBL8561322 | 0.83 | SYK (0.40) | CA1CA2ACHESYKGHSR | |
| SCHEMBL8567143 | 0.83 | CA1 (0.39) | CA1CA2ACHESYKGHSR | |
| SCHEMBL8575729 | 0.83 | CA1 (0.39) | CA1CA2ACHESYKGHSR | |
| SCHEMBL8997628 | 0.82 | CA1 (0.34) | CA1CA2ACHESYKGHSR | |
| SCHEMBL8997631 | 0.82 | SYK (0.35) | CA1CA2ACHESYKGHSR | |
| SCHEMBL8580646 | 0.82 | GHSR (0.42) | GHSRALDH1A1HTTCTDSP1ESR2 | |
| SCHEMBL8997600 | 0.81 | SYK (0.40) | CA1CA2ACHESYKALDH1A1 |
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 |