Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL2111012 | 0.82 | EPHX1 (0.44) | EPHX1ALDH1A1LMNAMAPTALOX12 | |
| SCHEMBL28109830 | 0.80 | EPHX1 (0.33) | EPHX1ALDH1A1LMNAMAPTALOX12 | |
| SCHEMBL15282809 | 0.80 | EPHX1 (0.42) | EPHX1ALDH1A1LMNAMAPTALOX12 | |
| SCHEMBL2109978 | 0.80 | EPHX1 (0.42) | EPHX1ALDH1A1LMNAMAPTALOX12 | |
| SCHEMBL9913310 | 0.79 | EPHX1 (0.43) | EPHX1ALDH1A1LMNAMAPTALOX12 | |
| SCHEMBL2631667 | 0.79 | EPHX1 (0.43) | EPHX1ALDH1A1LMNAMAPTALOX12 | |
| SCHEMBL2109375 | 0.79 | EPHX1 (0.43) | EPHX1ALDH1A1LMNAMAPTALOX12 | |
| SCHEMBL7924322 | 0.79 | EPHX1 (0.43) | EPHX1ALDH1A1LMNAMAPTALOX12 | |
| SCHEMBL2109377 | 0.79 | EPHX1 (0.43) | EPHX1ALDH1A1LMNAMAPTALOX12 | |
| SCHEMBL15705150 | 0.78 | EPHX1 (0.45) | EPHX1ALDH1A1LMNAMAPTALOX12 |
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-2014013076-A1 | HEXAHYDROPYRROLOTHIAZINE COMPOUNDS | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2014-01-23 | — | — | WO | disclosed |