Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | KARS1 | Q15046 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.30 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.30 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13070864 | 0.94 | TSHR (0.33) | TSHRMAPK1ATMTDP1L3MBTL1 | |
| SCHEMBL2707193 | 0.87 | HSD17B10 (0.33) | MEN1KMT2AMAPTALDH1A1PDK2 | |
| SCHEMBL18542710 | 0.83 | LMNA (0.36) | MEN1KMT2AMAPTALDH1A1PDK2 | |
| SCHEMBL2756772 | 0.81 | HTR2A (0.33) | PDK2 | |
| SCHEMBL13071136 | 0.80 | CNR2 (0.35) | PARP1PDK2 | |
| SCHEMBL15855088 | 0.79 | PDK2 (0.41) | MAPK1TDP1L3MBTL1MEN1KMT2A | |
| SCHEMBL25704456 | 0.79 | CYP1A2 (0.39) | MAPK1L3MBTL1MEN1KMT2APARP1 | |
| SCHEMBL17656225 | 0.79 | AKR1C3 (0.38) | TSHRMAPK1ATMTDP1L3MBTL1 | |
| SCHEMBL13071040 | 0.78 | HTR2A (0.33) | — | |
| SCHEMBL20055074 | 0.73 | PARP1 (0.40) | MEN1KMT2AAKR1C3AKR1C2PARP1 |
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-3002281-A1 | ANTIVIRAL COMPOUNDS | Gilead Pharmasset LLC (US) | 2016-04-06 | — | — | EP | disclosed |