Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CDC25B | P30305 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9728943 | 0.82 | ALDH1A1 (0.58) | AKR1C3KMT2ATDP1KDM4EHPGD | |
| SCHEMBL9299115 | 0.81 | AKR1C3 (0.61) | AKR1C3MAPTGAAKMT2AMAPK1 | |
| SCHEMBL9860289 | 0.81 | AKR1C3 (0.61) | AKR1C3MAPTGAAKMT2AMAPK1 | |
| SCHEMBL11373627 | 0.80 | KMT2A (0.73) | MAPTKMT2ANPC1MAPK1TDP1 | |
| Hydrogen Peroxide SCHEMBL28455182 | 0.80 | KMT2A (0.73) | MAPTKMT2ANPC1MAPK1TDP1 | |
| Benzene SCHEMBL8209405 | 0.80 | KMT2A (0.73) | MAPTKMT2ANPC1MAPK1TDP1 | |
| SCHEMBL15116 | 0.80 | KMT2A (0.73) | MAPTKMT2ANPC1MAPK1TDP1 | |
| SCHEMBL29447165 | 0.79 | AKR1C3 (0.85) | AKR1C3MAPTGAAKMT2ATDP1 | |
| SCHEMBL700595 | 0.79 | AKR1C3 (0.85) | AKR1C3MAPTGAAKMT2ATDP1 | |
| SCHEMBL9329254 | 0.79 | AKR1C3 (0.63) | AKR1C3MAPTGAAKMT2AMAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2258365-B1 | USE OF ORGANIC COMPOUNDS FOR IMMUNOPOTENTIATION | NOVARTIS VACCINES & DIAGNOSTIC (US) | 2013-05-29 | — | — | EP | disclosed |