Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 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 | |
|---|---|---|---|---|
| SCHEMBL20371006 | 0.89 | ALDH1A1 (0.42) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL26299297 | 0.83 | ALDH1A1 (0.51) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL28184112 | 0.82 | ESR2 (0.42) | TP53TSHRMAPTHPGDMEN1 | |
| SCHEMBL24394464 | 0.82 | TDP1 (0.54) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL5598711 | 0.82 | TDP1 (0.54) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL14969345 | 0.82 | TDP1 (0.54) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL18932143 | 0.80 | ESR1 (0.55) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL26870931 | 0.80 | TDP1 (0.59) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL28375632 | 0.80 | ALDH1A1 (0.48) | ALDH1A1TP53TSHRMAPTHPGD | |
| SCHEMBL18230814 | 0.78 | PKM (0.57) | ALDH1A1TP53TSHRMAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018129012-A1 | METHODS FOR SYNTHESIZING HIGH PURITY EPOXY COMPOUNDS AND PRODUCTS OBTAINED THEREFROM | SABIC GLOBAL TECHNOLOGIES B.V. (NL) | 2018-07-12 | — | — | WO | disclosed |