Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5039137 | 0.86 | POLB (0.40) | CYP3A4CYP11B1CYP11B2ALDH1A1MAPT | |
| SCHEMBL5034783 | 0.85 | CYP3A4 (0.43) | CYP3A4ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL5041330 | 0.82 | CYP3A4 (0.44) | CYP3A4CYP11B1CYP11B2ALDH1A1CYP1A2 | |
| SCHEMBL5036060 | 0.82 | CYP3A4 (0.43) | CYP3A4CYP11B1CYP11B2CYP1A2CYP2C9 | |
| SCHEMBL5035060 | 0.82 | CYP3A4 (0.42) | CYP3A4ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL5035268 | 0.82 | LIPE (0.47) | CYP3A4CYP11B1CYP11B2ALDH1A1KMT2A | |
| SCHEMBL5032567 | 0.82 | CYP3A4 (0.49) | CYP3A4CYP11B1CYP11B2ALDH1A1CYP1A2 | |
| SCHEMBL5035238 | 0.82 | LIPE (0.45) | — | |
| SCHEMBL5041310 | 0.81 | CES2 (0.37) | ALDH1A1MAPTKMT2AKDM4EMEN1 | |
| SCHEMBL5034905 | 0.81 | CYP3A4 (0.35) | CYP3A4CYP11B1CYP11B2MAPTKMT2A |
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-1694673-B1 | THIAZOLE DERIVATES | HOFFMANN LA ROCHE (CH) | 2008-01-16 | — | — | EP | claimed |