Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HBB | P68871 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1099292 | 0.78 | ABCG2 (0.37) | ABCG2CYP3A4ALDH1A1KMT2AHSD17B10 | |
| SCHEMBL6847374 | 0.74 | ABCG2 (0.37) | ABCG2CYP3A4ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL2595348 | 0.74 | ABCG2 (0.37) | ABCG2CYP3A4ALDH1A1NPC1RAB9A | |
| SCHEMBL744928 | 0.74 | ABCG2 (0.37) | ABCG2CYP3A4ALDH1A1HSD17B10TDP1 | |
| SCHEMBL8121070 | 0.67 | TXNRD1 (0.44) | CYP3A4ALDH1A1MAPTKDM4EKMT2A | |
| SCHEMBL510552 | 0.65 | MAPT (0.30) | MAPTKMT2AMEN1NPC1RAB9A | |
| SCHEMBL5680450 | 0.65 | ABCG2 (0.38) | ABCG2CYP3A4TDP1 | |
| SCHEMBL7629626 | 0.64 | MAOB (0.33) | CYP3A4ALDH1A1 | |
| SCHEMBL351622 | 0.63 | NOTUM (0.31) | — | |
| SCHEMBL5680495 | 0.62 | — | — |
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-5756426-A | Phenyl acetic acid derivatives as pesticides | NOVARTIS CORPORATION (US) | 1998-05-26 | — | — | US | disclosed |