Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | PGK1 | P00558 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | VCAM1 | P19320 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7621563 | 0.74 | HTT (0.45) | CA12CA9ALDH1A1MAPK1KDM4E | |
| SCHEMBL7267580 | 0.73 | PGK1 (0.34) | CA12CA9PGK1ALDH1A1KDM4E | |
| SCHEMBL7267544 | 0.71 | PGK1 (0.33) | CA12CA9PGK1KDM4EMAPT | |
| SCHEMBL25210239 | 0.69 | PGK1 (0.44) | PGK1ALDH1A1CYP3A4TSHRMAPK1 | |
| SCHEMBL10347618 | 0.69 | PGK1 (0.41) | CA12CA9PGK1ALDH1A1CYP3A4 | |
| SCHEMBL7626842 | 0.68 | SMN1; SMN2 (0.39) | ALDH1A1MAPK1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL7619385 | 0.67 | KDM4E (0.49) | ALDH1A1MAPK1KDM4EMAPTHTT | |
| SCHEMBL9180125 | 0.66 | TSHR (0.62) | PGK1ALDH1A1CYP3A4TSHRMAPK1 | |
| SCHEMBL6109031 | 0.65 | PGK1 (0.58) | CA12CA9PGK1ALDH1A1CYP3A4 | |
| SCHEMBL8135844 | 0.65 | PGK1 (0.47) | CA12CA9PGK1ALDH1A1CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005007634-A1 | 3-HYDROXY-4-OXO-1,2,3-TRIAZINES AND DERIVATIVES THEREOF FOR AMIDE AND ESTER BOND FORMATION | FRUTAROM LTD. (IL) | 2005-01-27 | — | — | WO | claimed |
| WO-2005007634-A1 | 3-HYDROXY-4-OXO-1,2,3-TRIAZINES AND DERIVATIVES THEREOF FOR AMIDE AND ESTER BOND FORMATION | FRUTAROM LTD. (IL) | 2005-01-27 | — | — | WO | disclosed |