Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | F13A1 | P00488 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | SNCA | P37840 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7416057 | 0.99 | MAPT (0.40) | MEN1MAPTKMT2ATDP1F13A1 | |
| SCHEMBL7420295 | 0.96 | HPGD (0.38) | MEN1MAPTKMT2ATDP1HPGD | |
| SCHEMBL7412951 | 0.90 | FBP1 (0.43) | MEN1MAPTKMT2ATDP1HPGD | |
| SCHEMBL7414973 | 0.83 | IMPDH2 (0.40) | MAPTALDH1A1TTRLMNAIMPDH2 | |
| SCHEMBL7408115 | 0.82 | IMPDH2 (0.39) | MEN1MAPTKMT2ATDP1TTR | |
| SCHEMBL6036336 | 0.82 | CYP1A2 (0.44) | MEN1MAPTKMT2ATDP1HPGD | |
| SCHEMBL7412241 | 0.79 | IMPDH2 (0.41) | MAPTTTRLMNAIMPDH2 | |
| SCHEMBL7418340 | 0.78 | XDH (0.42) | MEN1MAPTKMT2ATDP1HPGD | |
| SCHEMBL7278917 | 0.77 | TTR (0.46) | MEN1MAPTKMT2ATDP1HPGD | |
| SCHEMBL8848662 | 0.77 | SNCA (0.57) | MEN1MAPTKMT2ATDP1F13A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6150412-A | SUCH AS 4-(5-HYDROXY-4-METHOXY-2-NITROPHENYL)BUTANOIC ACID; ADMINISTERING TO INHIBIT CATECHOL-O-METHYL TRANSFERASE; TREATING PARKINSON'S DISEASE OR HYPERTENSION | ORION-YHTYMA OY (FI) | 2000-11-21 | — | — | US | disclosed |
| WO-1996037456-A1 | NEW CATECHOL DERIVATIVES | Orion-Yhtymä Oy (FI) | 1996-11-28 | — | — | WO | disclosed |