Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | CES2 | O00748 | 2/20 | 0.37 |
| ▸ | CES1 | P23141 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.33 |
| ▸ | ALPI | P09923 | 1/20 | 0.33 |
| ▸ | ALPG | P10696 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | FABP2 | P12104 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL2334592 | 0.79 | EPHX2 (0.38) | EPHX2CES2CES1NPC1ALPL | |
| SCHEMBL2088760 | 0.77 | MEN1 (0.41) | ALDH1A1HTTTP53MEN1KMT2A | |
| SCHEMBL29665656 | 0.77 | MEN1 (0.41) | ALDH1A1HTTTP53MEN1KMT2A | |
| SCHEMBL7806144 | 0.69 | KMT2A (0.43) | NPC1APPKMT2A | |
| SCHEMBL7806141 | 0.69 | KMT2A (0.43) | NPC1APPKMT2A | |
| SCHEMBL7026221 | 0.69 | MAPK1 (0.38) | NPC1ALDH1A1HTTTP53MEN1 | |
| SCHEMBL3654599 | 0.69 | EPHX2 (0.35) | EPHX2CES2CES1NPC1ALDH1A1 | |
| SCHEMBL4849068 | 0.68 | GAA (0.45) | EPHX2CES2CES1NPC1ALPL | |
| SCHEMBL7695978 | 0.68 | EPHX2 (0.40) | EPHX2CES2CES1ALPLALPI | |
| SCHEMBL18509438 | 0.68 | ESR2 (0.36) | ALDH1A1MEN1KMT2APOLB |
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-2360160-A1 | Intermediates and their use for producing benzoxazine derivative | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2011-08-24 | — | — | EP | disclosed |