Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 6/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 6/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.36 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.36 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | GRK6 | P43250 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TTR | P02766 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4950976 | 0.88 | CRHBP (0.42) | MEN1ALDH1A1KMT2AABCC1ERN1 | |
| SCHEMBL4948139 | 0.82 | FYN (0.40) | MEN1KMT2AMAPTLMNA | |
| SCHEMBL3579413 | 0.75 | SMN1; SMN2 (0.42) | ALOX5MEN1ALDH1A1KMT2AABCB1 | |
| SCHEMBL1446971 | 0.72 | ABCC1 (0.40) | ALOX5MEN1ALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL4948557 | 0.62 | TTR (0.51) | MEN1ALDH1A1KMT2AL3MBTL1ABCB1 | |
| SCHEMBL7367724 | 0.61 | TTR (0.57) | MEN1ALDH1A1KMT2AABCB1ABCC1 | |
| SCHEMBL12118500 | 0.61 | GPR35 (0.57) | MEN1ALDH1A1KMT2AERN1MAPT | |
| SCHEMBL3590761 | 0.61 | CRHBP (0.49) | ABCC1ERN1CRHBPCRHR2MAPT | |
| SCHEMBL3584563 | 0.61 | TTR (0.53) | MEN1ALDH1A1KMT2AL3MBTL1ABCB1 | |
| SCHEMBL20022338 | 0.61 | TTR (0.66) | MEN1ALDH1A1KMT2AL3MBTL1ABCB1 |
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 |