Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | AHR | P35869 | 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 | |
|---|---|---|---|---|
| SCHEMBL6901214 | 0.75 | ABCB1 (0.36) | ABCB1ALDH1A1TDP1MEN1KMT2A | |
| SCHEMBL471917 | 0.70 | MEN1 (0.37) | ALDH1A1MEN1RAB9AKMT2AL3MBTL1 | |
| SCHEMBL93318 | 0.70 | MEN1 (0.37) | ALDH1A1MEN1RAB9AKMT2AL3MBTL1 | |
| SCHEMBL27213064 | 0.69 | AGXT (0.44) | ALDH1A1TDP1MEN1RAB9AKMT2A | |
| SCHEMBL6935317 | 0.67 | ALDH1A1 (0.33) | ALDH1A1LMNA | |
| SCHEMBL6653044 | 0.67 | CYP2D6 (0.35) | — | |
| SCHEMBL134386 | 0.67 | CYP2D6 (0.35) | — | |
| SCHEMBL27505728 | 0.67 | CYP11B1 (0.42) | MEN1KMT2AMAPT | |
| SCHEMBL6900265 | 0.67 | ABCB1 (0.47) | ABCB1ALDH1A1TDP1MEN1KMT2A | |
| SCHEMBL9019533 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2004315458-A | METHOD FOR REFINING EPISULFIDE COMPOSITION | MITSUI CHEMICALS INC | 2004-11-11 | — | — | JP | disclosed |