Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | RECQL | P46063 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.34 |
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | TDO2 | P48775 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | BLM | P54132 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 3/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | CRHBP | P24387 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4948714 | 0.83 | MAPT (0.37) | MEN1ALDH1A1MAPTKMT2ALMNA | |
| SCHEMBL1447172 | 0.82 | COMT (0.46) | TTRMAPTPOLBGAATP53 | |
| SCHEMBL4951393 | 0.78 | TTR (0.34) | TTRKDM4EMEN1ALDH1A1MAPT | |
| SCHEMBL3585312 | 0.75 | TTR (0.41) | TTRKDM4EMEN1ALDH1A1MAPT | |
| SCHEMBL4949041 | 0.74 | TTR (0.35) | TTRKDM4EMEN1ALDH1A1MAPT | |
| SCHEMBL3595074 | 0.73 | MAPT (0.44) | TTRKDM4EMEN1ALDH1A1MAPT | |
| SCHEMBL3588381 | 0.73 | TTR (0.45) | TTRKDM4EMEN1ALDH1A1MAPT | |
| SCHEMBL3587064 | 0.73 | TTR (0.39) | TTRKDM4EMEN1ALDH1A1MAPT | |
| SCHEMBL3591192 | 0.73 | TTR (0.39) | TTRKDM4EMEN1ALDH1A1MAPT | |
| SCHEMBL3586419 | 0.72 | MAPT (0.39) | TTRKDM4EMEN1ALDH1A1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1907382-A1 | NITROCATECHOL DERIVATIVES AS COMT INHIBITORS | Portela & C.A. S.A (PT) | 2008-04-09 | — | — | EP | disclosed |
| WO-2007013830-A1 | NITROCATECHOL DERIVATIVES AS COMT INHIBITORS | PORTELA & CA. S.A. (PT) | 2007-02-01 | — | — | WO | disclosed |