Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 2/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | TACR2 | P21452 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1072194 | 0.80 | CALM1 (0.44) | IDH1CYP2A6ALDH1A1LMNANPSR1 | |
| SCHEMBL29955975 | 0.80 | CYP2A6 (0.42) | CYP2A6HSD17B10ALDH1A1MAPT | |
| SCHEMBL2011005 | 0.80 | CYP2A6 (0.42) | CYP2A6HSD17B10ALDH1A1MAPT | |
| SCHEMBL2222928 | 0.78 | ALDH1A1 (0.62) | IDH1CYP2A6HSD17B10ALDH1A1LMNA | |
| SCHEMBL17508269 | 0.75 | CYP2A6 (0.54) | IDH1CYP2A6HSD17B10ALDH1A1MAPT | |
| SCHEMBL17521457 | 0.74 | MAOA (0.54) | CYP2A6TP53POLBMAPTMAOA | |
| SCHEMBL8992816 | 0.74 | HSD17B10 (0.48) | HSD17B10ALDH1A1LMNAPGRLTA4H | |
| SCHEMBL20546774 | 0.72 | CYP2A6 (0.76) | CYP2A6HSD17B10ALDH1A1TP53MAPT | |
| Diphenylmethane SCHEMBL28055727 | 0.72 | ALDH1A1 (0.74) | IDH1CYP2A6ALDH1A1LMNANPSR1 | |
| Benzaldehyde SCHEMBL28085758 | 0.70 | ALDH1A1 (0.70) | CYP2A6ALDH1A1LMNANPSR1MAOA |
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 |
|---|---|---|---|---|---|---|---|
| US-6165234-A | FOR IMPARTING REVERSIBLE COLOR CHANGES TO WAXES AND CANDLES WHEN HEATED OR WHEN WAX MELTS OR WHEN THE CANDLE BURNS | KANAKKANATT SEBASTIAN V (US) | 2000-12-26 | — | — | US | disclosed |