Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | FAAH | O00519 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | EP300 | Q09472 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PTP4A1 | Q93096 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MIF | P14174 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11208867 | 1.00 | CYP2C9 (0.53) | CYP2C9MAPTMEN1KMT2AGAA | |
| SCHEMBL8600351 | 1.00 | CYP2C9 (0.53) | CYP2C9MAPTMEN1KMT2AGAA | |
| SCHEMBL6696710 | 0.98 | CYP2C9 (0.54) | CYP2C9MAPTMEN1KMT2AGAA | |
| SCHEMBL10899312 | 0.93 | CYP2C9 (0.56) | CYP2C9MAPTMEN1KMT2AGAA | |
| SCHEMBL11256760 | 0.93 | CYP2C9 (0.56) | CYP2C9MAPTMEN1KMT2AGAA | |
| SCHEMBL20472622 | 0.89 | TSHR (0.47) | CYP2C9MAPTMEN1KMT2AGAA | |
| SCHEMBL7743277 | 0.89 | TSHR (0.44) | CYP2C9MAPTMEN1KMT2AGAA | |
| SCHEMBL7743274 | 0.89 | TSHR (0.44) | CYP2C9MAPTMEN1KMT2AGAA | |
| SCHEMBL13703525 | 0.89 | TSHR (0.47) | CYP2C9MAPTMEN1KMT2AGAA | |
| SCHEMBL7745807 | 0.89 | TSHR (0.44) | CYP2C9MAPTMEN1KMT2AGAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0866786-B1 | BASIC CATALYSTS FOR THE ALDOL REACTION | NOVARTIS AG (CH) | 2000-05-10 | — | — | EP | disclosed |
| US-5977290-A | Basic catalysts for the aldol reaction | NOVARTIS AG (CH) | 1999-11-02 | — | — | US | disclosed |
| EP-0866786-A1 | BASIC CATALYSTS FOR THE ALDOL REACTION | Novartis AG (CH) | 1998-09-30 | — | — | EP | disclosed |
| WO-1997021659-A1 | BASIC CATALYSTS FOR THE ALDOL REACTION | NOVARTIS AG (CH) | 1997-06-19 | — | — | WO | disclosed |