Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 3/20 | 0.45 |
| ▸ | HTR2C | P28335 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | THRA | P10827 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16610334 | 0.88 | THRB (0.44) | KDM4EAKR1C3POLBKMT2AMEN1 | |
| SCHEMBL16610426 | 0.87 | THRA (0.40) | KDM4EAKR1C3POLBKMT2AMEN1 | |
| SCHEMBL16610416 | 0.87 | HTR1A (0.43) | KDM4EAKR1C3POLBKMT2AMEN1 | |
| SCHEMBL16610411 | 0.86 | APP (0.41) | KMT2AMEN1HTR1AHTR2CALDH1A1 | |
| SCHEMBL16610407 | 0.82 | ALDH1A1 (0.39) | KDM4EPOLBKMT2AMEN1ALDH1A1 | |
| SCHEMBL6023949 | 0.79 | PKM (0.62) | KDM4EAKR1C3POLBKMT2AMEN1 | |
| SCHEMBL6023916 | 0.79 | PKM (0.62) | KDM4EAKR1C3POLBKMT2AMEN1 | |
| SCHEMBL16610368 | 0.77 | KDM4E (0.72) | KDM4EHTR1AHTR2CALDH1A1HPGD | |
| SCHEMBL16610422 | 0.76 | THRB (0.46) | KDM4EAKR1C3POLBKMT2AMEN1 | |
| SCHEMBL16048499 | 0.76 | KDM4E (0.61) | KDM4EPOLBHTR1AHTR2CALDH1A1 |
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-2015043522-A1 | TRIFLUOROMETHYL-CONTAINING AMIDE ALKALOID, MANUFACTURING METHOD AND PHARMACEUTICAL USE THEREOF | 天士力制药集团股份有限公司 | 2015-04-02 | — | — | WO | disclosed |