Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.38 |
| ▸ | KLK7 | P49862 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16624723 | 0.87 | ALDH1A1 (0.41) | ALDH1A1PSMB8PSMB5HTTNPSR1 | |
| SCHEMBL27971255 | 0.81 | KDM4E (0.48) | ALDH1A1POLBHTTNPSR1HPGD | |
| SCHEMBL17954338 | 0.73 | ALDH1A1 (0.49) | ALDH1A1HTTNPSR1HPGDMAPT | |
| SCHEMBL16624680 | 0.72 | ALDH1A1 (0.53) | ALDH1A1POLBTHRBHTTNPSR1 | |
| SCHEMBL16624812 | 0.71 | SMN1; SMN2 (0.64) | ALDH1A1PSMB8PSMB5HTTNPSR1 | |
| SCHEMBL27971113 | 0.70 | ALDH1A1 (0.60) | ALDH1A1POLBHTTNPSR1HPGD | |
| SCHEMBL16624654 | 0.70 | TDP1 (0.39) | PSMB8PSMB5HPGDSMN1; SMN2MAPK1 | |
| SCHEMBL16624688 | 0.69 | ALDH1A1 (0.50) | ALDH1A1HTTNPSR1HPGDMAPT | |
| SCHEMBL19658180 | 0.69 | KMT2A (0.41) | ALDH1A1PSMB8PSMB5HPGDMAPT | |
| SCHEMBL21610292 | 0.69 | ALDH1A1 (0.49) | ALDH1A1HTTNPSR1HPGDMAPT |
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-3052107-B1 | ORGANIC COMPOUNDS TO TREAT HEPATITIS B VIRUS | NOVARTIS AG (CH) | 2018-05-02 | — | — | EP | disclosed |