Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.35 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | VNN1 | O95497 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.32 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16891683 | 0.77 | GAA (0.39) | GAAHPGDEPHX2CYP1A2CYP3A4 | |
| SCHEMBL25467700 | 0.76 | L3MBTL1 (0.41) | GAAEPHX2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL25434734 | 0.74 | HDAC6 (0.52) | CYP1A2CYP3A4CYP2C9MEN1KMT2A | |
| SCHEMBL25404860 | 0.68 | HTT (0.41) | GAACYP1A2CYP3A4CYP2C9LMNA | |
| SCHEMBL19387993 | 0.68 | CA1 (0.47) | HPGDCYP1A2CYP3A4CYP2C9LMNA | |
| SCHEMBL1227049 | 0.66 | NAPRT (0.57) | GAAHPGDCYP3A4LMNAALDH1A1 | |
| SCHEMBL23973874 | 0.65 | POLB (0.66) | LMNAPOLBKMT2A | |
| Hydrochloric Acid SCHEMBL1373539 | 0.65 | NAPRT (0.55) | GAAHPGDCYP3A4LMNAALDH1A1 | |
| SCHEMBL474360 | 0.65 | CA2 (0.46) | CYP1A2CYP3A4CYP2C9VNN1HCAR2 | |
| SCHEMBL16887645 | 0.65 | HCAR2 (0.41) | CYP1A2CYP3A4CYP2C9ALDH1A1POLB |
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-2023078238-A1 | SARS-COV-2 INHIBITORS FOR TREATING CORONAVIRUS INFECTIONS | INSILICO MEDICINE IP LIMITED (CN) | 2023-05-11 | — | — | WO | disclosed |