Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.49 |
| ▸ | TTR | P02766 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3208961 | 0.93 | ALOX5 (0.55) | ALOX5TTRMEN1KMT2ABACE1 | |
| SCHEMBL20152931 | 0.92 | TTR (0.44) | ALOX5TTRMEN1KMT2ABACE1 | |
| SCHEMBL20152905 | 0.91 | TTR (0.43) | ALOX5TTRMEN1KMT2ABACE1 | |
| SCHEMBL5034496 | 0.87 | BACE1 (0.48) | TTRMEN1KMT2ABACE1KDM4E | |
| SCHEMBL20152889 | 0.86 | ALOX5 (0.48) | ALOX5TTRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL6035879 | 0.83 | CYP4F2 (0.50) | TTRMEN1KMT2APOLBKDM4E | |
| SCHEMBL7332981 | 0.83 | HSD17B10 (0.63) | POLBHSD17B10 | |
| SCHEMBL28107143 | 0.83 | FFAR1 (0.49) | ALOX5ALDH1A1 | |
| SCHEMBL178369 | 0.80 | MAOB (0.52) | ALOX5TTRMEN1KMT2ABACE1 | |
| SCHEMBL14308495 | 0.79 | TAAR1 (0.66) | MEN1KMT2AMAOBCYP1A2CYP3A4 |
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-2018086197-A1 | CATALYTIC ASYMMETRIC SYNTHESIS METHOD FOR CHIRAL SPINOL DERIVATE | 南方科技大学 | 2018-05-17 | — | — | WO | disclosed |