Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.45 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | PKLR | P30613 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | HTR7 | P34969 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7714208 | 0.99 | PKM (0.52) | PKMALDH1A1NPSR1LMNAKDR | |
| Hydrochloric Acid SCHEMBL7698673 | 0.99 | PKM (0.52) | PKMALDH1A1NPSR1LMNAKDR | |
| Hydrochloric Acid SCHEMBL7696531 | 0.99 | PKM (0.52) | PKMALDH1A1NPSR1LMNAKDR | |
| SCHEMBL24571882 | 0.91 | PKM (0.59) | PKMALDH1A1NPSR1LMNAPKLR | |
| SCHEMBL31437044 | 0.91 | PKM (0.59) | PKMALDH1A1NPSR1LMNAPKLR | |
| SCHEMBL1714190 | 0.82 | GAA (0.54) | PKMALDH1A1LMNAKDRPOLB | |
| SCHEMBL15651732 | 0.81 | KDR (0.44) | ALDH1A1NPSR1LMNAKDRPDK1 | |
| Hydrochloric Acid SCHEMBL4963034 | 0.80 | GAA (0.53) | PKMALDH1A1LMNAKDRPOLB | |
| Hydrochloric Acid SCHEMBL4963047 | 0.80 | GAA (0.53) | PKMALDH1A1LMNAKDRPOLB | |
| SCHEMBL12727845 | 0.80 | GAA (0.56) | PKMLMNAPKLRKMT2AMEN1 |
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-2002020015-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2002-03-14 | — | — | WO | disclosed |