Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.53 |
| ▸ | PPARA | Q07869 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.53 |
| ▸ | NQO1 | P15559 | 1/20 | 0.50 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9590123 | 0.79 | PPARA (0.52) | CYP1A2PPARACYP3A4ABCB11TSHR | |
| SCHEMBL135713 | 0.79 | PPARA (0.72) | CYP1A2PPARACYP3A4ABCB11TSHR | |
| SCHEMBL29184208 | 0.79 | PPARA (0.52) | CYP1A2PPARACYP3A4ABCB11TSHR | |
| SCHEMBL3573347 | 0.78 | PPARA (0.50) | CYP1A2PPARACYP3A4ABCB11TSHR | |
| SCHEMBL11734716 | 0.78 | PPARA (0.50) | CYP1A2PPARACYP3A4ABCB11TSHR | |
| SCHEMBL11550869 | 0.78 | PPARA (0.50) | CYP1A2PPARACYP3A4ABCB11TSHR | |
| SCHEMBL1805865 | 0.77 | PPARA (0.53) | CYP1A2PPARACYP3A4ABCB11TSHR | |
| SCHEMBL1148349 | 0.76 | NQO1 (0.52) | CYP1A2PPARACYP3A4TSHRNQO1 | |
| SCHEMBL9589722 | 0.76 | L3MBTL1 (0.53) | CYP1A2KMT2AMEN1MAPTCYP2C19 | |
| SCHEMBL11537290 | 0.75 | PPARA (0.66) | CYP1A2PPARACYP3A4ABCB11TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5200549-A | Anticholesterol agents | HOFFMAN-LA ROCHE INC. (US) | 1993-04-06 | — | — | US | disclosed |
| US-5073568-A | Treating skin disorder; anticholesterol agent | HOFFMANN-LA ROCHE INC. (US) | 1991-12-17 | — | — | US | disclosed |