Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.45 |
| ▸ | SRC | P12931 | 1/20 | 0.45 |
| ▸ | MLYCD | O95822 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 4/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | CTSG | P08311 | 1/20 | 0.40 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.40 |
| ▸ | CMA1 | P23946 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9679833 | 0.94 | PPARA (0.45) | SRCMLYCDHPGDLMNAMAPT | |
| SCHEMBL9679941 | 0.87 | ALDH1A1 (0.46) | MLYCDHPGDLMNAMEN1KMT2A | |
| SCHEMBL10384876 | 0.84 | MLYCD (0.46) | MLYCDHPGDPOLBLMNAMEN1 | |
| SCHEMBL9681281 | 0.84 | CA1 (0.47) | CES1MLYCDTDP1LMNAMEN1 | |
| SCHEMBL9681018 | 0.83 | ALDH1A1 (0.50) | MLYCDHPGDPOLBTDP1TSHR | |
| SCHEMBL9681301 | 0.83 | MLYCD (0.45) | MLYCDHPGDMEN1KMT2AMAPT | |
| SCHEMBL4421870 | 0.81 | MLYCD (0.44) | MLYCDHPGDMEN1KMT2AMAPT | |
| SCHEMBL725631 | 0.81 | MLYCD (0.44) | MLYCDTSHRLMNAMEN1KMT2A | |
| SCHEMBL10384789 | 0.81 | CES1 (0.44) | CES1SRCMLYCDPOLBLMNA | |
| SCHEMBL4418642 | 0.80 | MLYCD (0.43) | MLYCDHPGDTSHRMEN1KMT2A |
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-4960746-A | A-HYDROXY-OR A-AMINO-ACETOPHENONES AND A TITANOCENE COMPOUND SUBSTITUTED BY FLUORINE | CIBA-GEIGY CORPORATION (US) | 1990-10-02 | — | — | US | disclosed |