Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HK2 | P52789 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | FAAH | O00519 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9462032 | 0.87 | ALDH1A1 (0.40) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL3384398 | 0.79 | ALDH1A1 (0.46) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL7219131 | 0.78 | NOTUM (0.35) | HPGDKMT2ASMN1; SMN2NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL11729437 | 0.77 | ALDH1A1 (0.45) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL24241764 | 0.76 | MAPT (0.44) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL11274712 | 0.75 | MAPT (0.37) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL11262648 | 0.74 | MAPT (0.38) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL24534438 | 0.73 | ALDH1A1 (0.42) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL7216154 | 0.72 | — | — | |
| SCHEMBL22505746 | 0.71 | MAPT (0.40) | ALDH1A1MAPTHPGDMEN1KMT2A |
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-6504046-B1 | Cyclization of nitriles using acids, to form oxazolinone chemical intermediates such as 2-phenyl-4-isopropyl-4-methyl-1,3-oxazol-5-one, used as fungicides | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 2003-01-07 | — | — | US | disclosed |
| EP-1092705-A1 | PROCESS FOR THE PREPARATION OF AMIDES | IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) | 2001-04-18 | — | — | EP | disclosed |