Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.64 |
| ▸ | NPC1 | O15118 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
| ▸ | MMP9 | P14780 | 1/20 | 0.48 |
| ▸ | MMP8 | P22894 | 1/20 | 0.48 |
| ▸ | MMP14 | P50281 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MME | P08473 | 2/20 | 0.46 |
| ▸ | ACACB | O00763 | 1/20 | 0.46 |
| ▸ | ACE | P12821 | 1/20 | 0.46 |
| ▸ | CPA1 | P15085 | 1/20 | 0.46 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL22300787 | 0.93 | MEN1 (0.59) | TAAR1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL22300785 | 0.89 | POLB (0.55) | TAAR1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL27272124 | 0.88 | TAAR1 (0.56) | TAAR1KMT2AMEN1NPC1RAB9A | |
| SCHEMBL13494637 | 0.83 | MME (0.55) | TAAR1KMT2AMEN1MMP9MME | |
| SCHEMBL6469693 | 0.83 | MEN1 (0.56) | TAAR1KMT2AMEN1EPHX1MMP9 | |
| SCHEMBL19033467 | 0.83 | MEN1 (0.56) | TAAR1KMT2AMEN1EPHX1MMP9 | |
| SCHEMBL23198617 | 0.83 | OPRM1 (0.58) | KMT2AMEN1MMP9MMP8ALDH1A1 | |
| SCHEMBL10272569 | 0.81 | MMP1 (0.62) | MMP9MMP8MMP14MME | |
| SCHEMBL23870352 | 0.81 | FCER2 (0.58) | MME | |
| SCHEMBL18800193 | 0.81 | MME (0.53) | TAAR1KMT2AMEN1MMEACE |
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 |
|---|---|---|---|---|---|---|---|
| EP-2629889-B1 | RUTHENIUM COMPLEXES AND THEIR USES IN PROCESSES FOR FORMATION AND/OR HYDROGENATION OF ESTERS, AMIDES AND DERIVATIVES THEREOF | YEDA RES & DEV (IL) | 2019-04-03 | — | — | EP | disclosed |