Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | APAF1 | O14727 | 1/20 | 0.34 |
| ▸ | TDP2 | O95551 | 1/20 | 0.34 |
| ▸ | NSD2 | O96028 | 1/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8548002 | 0.78 | MAPT (0.33) | ALDH1A1KDM4ENPC1RAB9AKMT2A | |
| SCHEMBL10471684 | 0.74 | NPSR1 (0.48) | ALDH1A1NPSR1KDM4EGAANPC1 | |
| SCHEMBL8541963 | 0.73 | SMN1; SMN2 (0.37) | ALDH1A1NPSR1CFTRKDM4EGAA | |
| SCHEMBL3076329 | 0.72 | ALDH1A1 (0.38) | ALDH1A1NPSR1CFTRKDM4EGAA | |
| SCHEMBL23725793 | 0.71 | NPC1 (0.39) | ALDH1A1NPSR1KDM4ENPC1RAB9A | |
| SCHEMBL8319338 | 0.71 | KDM4E (0.46) | ALDH1A1NPSR1CFTRKDM4EGAA | |
| SCHEMBL23725138 | 0.70 | NPC1 (0.40) | ALDH1A1NPSR1KDM4EGAANPC1 | |
| SCHEMBL9202023 | 0.70 | NPSR1 (0.44) | ALDH1A1NPSR1KDM4EGAANPC1 | |
| SCHEMBL3076346 | 0.69 | KDM4E (0.43) | ALDH1A1CFTRKDM4EGAANPC1 | |
| SCHEMBL29148117 | 0.69 | NR4A2 (0.43) | ALDH1A1PDK2PDK4KDM4EGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0434965-B1 | Alkyl esters of 5-heterocyclic-pyridine-2,3-dicarboxylic acids and 5-heterocyclic 2-(2-imidazolin-2-yl) pyridines and methods for preparation thereof | AMERICAN CYANAMID CO (US) | 1998-05-20 | — | — | EP | claimed |
| EP-0434965-A2 | Alkyl esters of 5-heterocyclic-pyridine-2,3-dicarboxylic acids and 5-heterocyclic 2-(2-imidazolin-2-yl) pyridines and methods for preparation thereof | AMERICAN CYANAMID COMPANY (US) | 1991-07-03 | — | — | EP | claimed |
| US-5026859-A | Intermediates for herbicides | AMERICAN CYANAMID COMPANY (US) | 1991-06-25 | — | — | US | claimed |