Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.78 |
| ▸ | MLKL | Q8NB16 | 3/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.66 |
| ▸ | POLB | P06746 | 1/20 | 0.66 |
| ▸ | GAA | P10253 | 3/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.53 |
| ▸ | MASP2 | O00187 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL30601597 | 0.89 | MLKL (0.77) | IDO1MLKLALDH1A1POLBGAA | |
| SCHEMBL899731 | 0.89 | MLKL (0.77) | IDO1MLKLALDH1A1POLBGAA | |
| SCHEMBL4921708 | 0.88 | IDO1 (1.00) | IDO1MLKLALDH1A1POLBGAA | |
| SCHEMBL900509 | 0.84 | IDO1 (0.62) | IDO1MLKLALDH1A1POLBGAA | |
| SCHEMBL29537224 | 0.84 | IDO1 (0.72) | IDO1MLKLALDH1A1POLBGAA | |
| SCHEMBL2673705 | 0.84 | IDO1 (0.72) | IDO1MLKLALDH1A1POLBGAA | |
| SCHEMBL19425511 | 0.84 | IDO1 (0.85) | IDO1MLKLALDH1A1POLBGAA | |
| SCHEMBL2674618 | 0.84 | IDO1 (0.72) | IDO1MLKLALDH1A1POLBGAA | |
| SCHEMBL19425618 | 0.84 | IDO1 (0.85) | IDO1MLKLALDH1A1POLBGAA | |
| SCHEMBL250817 | 0.84 | IDO1 (0.72) | IDO1MLKLALDH1A1POLBGAA |
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-6180788-B1 | METAL COMPLEXES FOR CATALYSTS WITH COPPER, SILVER OR GOLD | EXXON RESEARCH AND ENGINEERING COMPANY | 2001-01-30 | — | — | US | disclosed |