Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | PRKDC | P78527 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18181698 | 0.75 | ERN1 (0.34) | ERN1 | |
| SCHEMBL3437884 | 0.72 | LMNA (0.55) | ERN1ALDH1A1TDP1TSHRLMNA | |
| SCHEMBL1489158 | 0.71 | TDP1 (0.50) | ERN1ALDH1A1TDP1KDM4ETSHR | |
| SCHEMBL4572706 | 0.71 | IDO1 (0.32) | — | |
| SCHEMBL10490686 | 0.70 | ALDH1A1 (0.42) | ALDH1A1TDP1KDM4ETSHRMEN1 | |
| SCHEMBL8743280 | 0.70 | TDP1 (0.40) | ERN1ALDH1A1TDP1KDM4ETSHR | |
| SCHEMBL3964528 | 0.69 | ERN1 (0.45) | ERN1 | |
| SCHEMBL8519885 | 0.67 | MEN1 (0.42) | ERN1ALDH1A1TDP1TSHRLMNA | |
| SCHEMBL30600409 | 0.67 | ALDH1A1 (0.50) | ERN1ALDH1A1TDP1KDM4ETSHR | |
| SCHEMBL446933 | 0.67 | ALDH1A1 (0.50) | ERN1ALDH1A1TDP1KDM4ETSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0481788-B1 | Process for preparing ink jet recording head | CANON KK (JP) | 1997-01-02 | — | — | EP | claimed |
| WO-2016100754-A1 | QUANTITATIVE INTRAMOLECULAR FISSION IN OLIGOACENES, MATERIALS, AND METHODS OF USE THEREOF | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2016-06-23 | — | — | WO | disclosed |