Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA4 | P22748 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL27178061 | 0.80 | CA1 (0.75) | LMNACYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL27178058 | 0.80 | CA1 (0.75) | LMNACYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL24000933 | 0.80 | ALDH1A1 (0.44) | LMNACYP1A2CYP2C9CYP2C19GAA | |
| SCHEMBL17574147 | 0.78 | LMNA (0.64) | LMNACYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL24278525 | 0.78 | LMNA (0.64) | LMNACYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL8634898 | 0.78 | LMNA (0.74) | LMNACYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL8634895 | 0.78 | LMNA (0.74) | LMNACYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL14371231 | 0.77 | KMT2A (0.67) | LMNACYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL960636 | 0.77 | MAPT (0.61) | LMNACYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL960634 | 0.77 | MAPT (0.61) | LMNACYP1A2CYP2C9CYP2C19POLB |
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-3960729-A1 | COMPOUNDS AND METHODS OF TREATING INFECTIONS | Neoculi Pty Ltd (AU) | 2022-03-02 | — | — | EP | disclosed |