Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NAAA | Q02083 | 4/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL9758550 | 0.97 | NAAA (0.37) | PKMMEN1HTTKMT2ACYP1A2 | |
| SCHEMBL9759152 | 0.96 | NAAA (0.38) | PKMMEN1HTTKMT2ANAAA | |
| SCHEMBL9759387 | 0.96 | NAAA (0.38) | PKMMEN1HTTKMT2ANAAA | |
| SCHEMBL9757982 | 0.96 | MAPT (0.37) | PKMHTTCYP1A2NAAAALDH1A1 | |
| SCHEMBL9758891 | 0.95 | PKM (0.36) | PKMMEN1HTTKMT2ACYP1A2 | |
| SCHEMBL9759148 | 0.95 | MAPT (0.36) | PKMHTTCYP1A2NAAATP53 | |
| SCHEMBL9759088 | 0.93 | NAAA (0.37) | MEN1HTTKMT2ANAAAALDH1A1 | |
| SCHEMBL9759139 | 0.93 | NAAA (0.37) | MEN1HTTKMT2ANAAAALDH1A1 | |
| SCHEMBL9758502 | 0.93 | ALDH1A1 (0.35) | HTTCYP2C9ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL9757951 | 0.92 | NAAA (0.35) | HTTNAAATP53ALDH1A1EPHX1 |
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-4985583-A | Liquid Crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-01-15 | — | — | US | disclosed |