Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP3 | P08254 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7820978 | 0.84 | CA1 (0.50) | ALDH1A1EPHX1MEN1KMT2AHTT | |
| SCHEMBL8662669 | 0.82 | ALDH1A1 (0.44) | ALDH1A1EPHX1L3MBTL1GAARECQL | |
| SCHEMBL11019441 | 0.78 | EPHX1 (0.55) | ALDH1A1EPHX1POLBL3MBTL1GAA | |
| SCHEMBL11018640 | 0.74 | EPHX1 (0.50) | ALDH1A1EPHX1L3MBTL1LTA4HKMT2A | |
| SCHEMBL28347287 | 0.73 | ALDH1A1 (0.60) | ALDH1A1POLBL3MBTL1GAARECQL | |
| SCHEMBL28347286 | 0.73 | ALDH1A1 (0.60) | ALDH1A1POLBL3MBTL1GAARECQL | |
| SCHEMBL2355634 | 0.72 | LTA4H (0.75) | L3MBTL1LTA4HMEN1KMT2AATM | |
| SCHEMBL18063436 | 0.71 | ALDH1A1 (0.58) | ALDH1A1POLBL3MBTL1MAPK1LTA4H | |
| SCHEMBL27482754 | 0.71 | HTT (0.58) | ALDH1A1POLBL3MBTL1GAARECQL | |
| SCHEMBL27563914 | 0.71 | LTA4H (0.58) | L3MBTL1MAPK1LTA4HMEN1KMT2A |
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-0158947-A2 | Amino thiol dipeptides | E.R. Squibb & Sons, Inc. (US) | 1985-10-23 | — | — | EP | disclosed |