Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SQLE | Q14534 | 7/20 | 0.35 |
| ▸ | FNTA | P49354 | 3/20 | 0.35 |
| ▸ | FNTB | P49356 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.32 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4443625 | 0.87 | TSHR (0.32) | KMT2ATSHRFNTAFNTBALOX15 | |
| SCHEMBL9498334 | 0.83 | KMT2A (0.33) | KMT2AFNTAFNTB | |
| SCHEMBL1305306 | 0.78 | TSHR (0.34) | KMT2ATSHRFNTAFNTBALOX15 | |
| SCHEMBL1305305 | 0.78 | TSHR (0.34) | KMT2ATSHRFNTAFNTBALOX15 | |
| SCHEMBL28878931 | 0.78 | TSHR (0.44) | KMT2ATSHRSQLEALOX15MEN1 | |
| SCHEMBL10898290 | 0.77 | ALDH1A1 (0.33) | KMT2AMAPTALDH1A1 | |
| SCHEMBL8829060 | 0.77 | — | — | |
| SCHEMBL9229665 | 0.73 | SQLE (0.40) | KMT2ATSHRSQLEFNTAFNTB | |
| SCHEMBL8767075 | 0.73 | — | — | |
| SCHEMBL8767073 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5229477-A | Randomness | SHELL OIL COMPANY (US) | 1993-07-20 | — | — | US | disclosed |