Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PRKCA | P17252 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | ELANE | P08246 | 3/20 | 0.32 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GBA1 | P04062 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | BTN3A1 | O00481 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| Trimethylammonium SCHEMBL6061265 | 0.93 | POLB (0.40) | POLBGAANPSR1PRKCANPC1 | |
| Chloroform SCHEMBL8311138 | 0.91 | PRKCA (0.40) | POLBGAANPSR1PRKCANPC1 | |
| SCHEMBL26905306 | 0.84 | POLB (0.40) | POLBGAANPSR1PRKCACYP4F2 | |
| SCHEMBL4258156 | 0.84 | POLB (0.48) | POLBGAANPSR1PRKCANPC1 | |
| SCHEMBL7092851 | 0.82 | POLB (0.39) | POLBGAANPSR1PRKCACYP4F2 | |
| SCHEMBL2529168 | 0.82 | POLB (0.44) | POLBGAANPSR1PRKCANPC1 | |
| SCHEMBL9065598 | 0.79 | TSHR (0.34) | ELANECYP2C19ALDH1A1 | |
| SCHEMBL17860722 | 0.79 | CYP4F2 (0.36) | CYP4F2CYP4A11 | |
| SCHEMBL16174555 | 0.79 | PRKCA (0.33) | PRKCA | |
| SCHEMBL248949 | 0.79 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023162998-A1 | COMPOSITION INCLUDING IODO COMPOUND AND USE FOR SAME | 東ソー株式会社 | 2023-08-31 | — | — | WO | claimed |
| WO-2023162998-A1 | COMPOSITION INCLUDING IODO COMPOUND AND USE FOR SAME | 東ソー株式会社 | 2023-08-31 | — | — | WO | disclosed |
| US-4731361-A | Alkeneamidocephalosporin esters | SHIONOGI & CO., LTD. (JP) | 1988-03-15 | — | — | US | disclosed |
| US-4698352-A | 4-oxo-1,4-dihydronicotinic acid derivatives, salts thereof, and antibacterial agents containing the same | TOYAMA CHEMICAL CO., LTD. (JP) | 1987-10-06 | — | — | US | disclosed |