Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | JAK1 | P23458 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7723773 | 1.00 | CES2 (0.52) | CES2CES1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL27373888 | 0.81 | NPC1 (0.58) | CES2CES1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL7733858 | 0.79 | MEN1 (0.43) | CES2CES1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL4659374 | 0.78 | MTNR1A (0.46) | CES2CES1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL4659375 | 0.78 | MTNR1A (0.46) | CES2CES1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL7584602 | 0.78 | MTNR1A (0.46) | CES2CES1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL6904379 | 0.78 | CES2 (0.53) | CES2CES1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL29851622 | 0.78 | CES2 (0.53) | CES2CES1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL14313666 | 0.77 | NPC1 (0.54) | CES2CES1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL13035860 | 0.76 | KMT2A (0.47) | CES2CES1KDM4ESMN1; SMN2KMT2A |
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-6399787-B1 | TRANSITION METAL COMPLEX | PENN STATE RESEARCH FOUNDATION | 2002-06-04 | — | — | US | disclosed |
| WO-1999059721-A1 | CATALYTIC ASYMMETRIC HYDROGENATION, HYDROFORMYLATION, AND HYDROVINYLATION VIA TRANSITION METAL CATALYSTS WITH PHOSPHINES AND PHOSPHITES | THE PENN STATE RESEARCH FOUNDATION (US) | 1999-11-25 | — | — | WO | disclosed |