Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.37 |
| ▸ | CASR | P41180 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL8067912 | 0.79 | TDP1 (0.40) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL10862624 | 0.77 | TDP1 (0.37) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL2235269 | 0.74 | TDP1 (0.46) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL509947 | 0.74 | MEN1 (0.39) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL599102 | 0.72 | TRPA1 (0.60) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL6546836 | 0.72 | CASR (0.50) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL29757164 | 0.72 | TRPA1 (0.60) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL9685032 | 0.70 | TDP1 (0.48) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL18153972 | 0.70 | TDP1 (0.42) | TDP1TP53TRPA1LMNACHRM1 | |
| SCHEMBL21091489 | 0.70 | TDP1 (0.42) | TDP1TP53TRPA1LMNACHRM1 |
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-0178331-A1 | ALKYNOL COMPOUNDS AND ALCOHOL SEPARATING AGENTS | KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) | 1986-04-23 | — | — | EP | disclosed |