Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.35 |
| ▸ | KHK | P50053 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2435542 | 0.78 | CYP3A4 (0.56) | CYP3A4ALDH1A1THRBKDM4EMAPT | |
| SCHEMBL29054114 | 0.78 | GPR35 (0.41) | CYP3A4ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL4515950 | 0.77 | CYP3A4 (0.42) | CYP3A4ALDH1A1THRBKDM4EMAPT | |
| SCHEMBL1810042 | 0.77 | ALDH1A1 (0.58) | CYP3A4ALDH1A1THRBMAPTHPGD | |
| SCHEMBL15274595 | 0.76 | ALDH1A1 (0.38) | CYP3A4ALDH1A1THRBKDM4EMAPT | |
| SCHEMBL792557 | 0.75 | TRPV4 (0.35) | ALDH1A1TRPV4KHKVCAM1 | |
| SCHEMBL15277639 | 0.75 | ALDH1A1 (0.41) | CYP3A4ALDH1A1THRBKDM4EMAPT | |
| SCHEMBL14744326 | 0.75 | KHK (0.39) | CYP3A4ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL21051816 | 0.75 | KDM4E (0.40) | CYP3A4ALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL16236615 | 0.75 | KHK (0.43) | CYP3A4ALDH1A1THRBKDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013029338-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2013-03-07 | — | — | WO | disclosed |