Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP9 | P14780 | 1/20 | 0.57 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.56 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.56 |
| ▸ | RORC | P51449 | 11/20 | 0.53 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CTSG | P08311 | 1/20 | 0.47 |
| ▸ | CMA1 | P23946 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL175501 | 0.85 | CYP4F2 (0.60) | MMP9CYP4F2CYP4A11ALDH1A1GAA | |
| SCHEMBL2665972 | 0.84 | KMT2A (0.57) | RORCPSIP1ALDH1A1GAAKDM4E | |
| SCHEMBL1096091 | 0.84 | CYP4F2 (0.58) | MMP9CYP4F2CYP4A11ALDH1A1GAA | |
| SCHEMBL30898772 | 0.83 | IDO1 (0.56) | CYP4F2CYP4A11RORCPSIP1ALDH1A1 | |
| SCHEMBL4113212 | 0.82 | CYP4F2 (0.76) | CYP4F2CYP4A11ALDH1A1GAAKDM4E | |
| SCHEMBL23174344 | 0.82 | MMP9 (0.64) | MMP9CYP4F2CYP4A11RORCALDH1A1 | |
| SCHEMBL167112 | 0.82 | MMP9 (0.51) | MMP9CYP4F2CYP4A11RORCALDH1A1 | |
| SCHEMBL10141348 | 0.82 | CYP4F2 (0.56) | MMP9CYP4F2CYP4A11ALDH1A1GAA | |
| SCHEMBL22664337 | 0.82 | CA2 (0.58) | CYP4F2CYP4A11ALDH1A1GAAKDM4E | |
| SCHEMBL184666 | 0.82 | CYP4F2 (0.56) | MMP9CYP4F2CYP4A11ALDH1A1GAA |
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-2021228215-A1 | BIARYL COMPOUND CAPABLE OF SERVING AS RORγ REGULATOR | 上海辉启生物医药科技有限公司 | 2021-11-18 | — | — | WO | disclosed |
| WO-2012028100-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-08 | — | — | WO | disclosed |