Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.68 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | MLKL | Q8NB16 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL38662315 | 0.84 | IDO1 (0.66) | IDO1L3MBTL1ALDH1A1POLBMLKL | |
| SCHEMBL27915429 | 0.84 | IDO1 (0.66) | IDO1L3MBTL1ALDH1A1POLBMLKL | |
| SCHEMBL11687443 | 0.84 | IDO1 (0.66) | IDO1L3MBTL1ALDH1A1POLBMLKL | |
| SCHEMBL17329323 | 0.84 | IDO1 (0.66) | IDO1L3MBTL1ALDH1A1POLBMLKL | |
| SCHEMBL27915490 | 0.81 | IDO1 (0.62) | IDO1L3MBTL1ALDH1A1POLBMLKL | |
| SCHEMBL29683786 | 0.81 | CYP3A4 (0.65) | IDO1L3MBTL1ALDH1A1POLBMLKL | |
| SCHEMBL7946544 | 0.81 | IDO1 (0.78) | IDO1L3MBTL1ALDH1A1POLBMLKL | |
| SCHEMBL4921708 | 0.81 | IDO1 (1.00) | IDO1L3MBTL1ALDH1A1POLBMLKL | |
| SCHEMBL27980611 | 0.81 | TAAR1 (0.67) | IDO1L3MBTL1ALDH1A1POLBMLKL | |
| Hydrochloric Acid SCHEMBL29095769 | 0.79 | TAAR1 (0.65) | IDO1L3MBTL1ALDH1A1POLBMLKL |
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 |
|---|---|---|---|---|---|---|---|
| CN-104829634-B | A kind of thirty-two nucleus copper complex and preparation method thereof | 山西大学 | 2016-09-28 | — | — | CN | claimed |