Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 2/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL25690019 | 0.98 | NAAA (0.49) | NAAAEPHX1HTTCYP2C19MMP1 | |
| SCHEMBL11574874 | 0.98 | NAAA (0.49) | NAAAEPHX1HTTCYP2C19MMP1 | |
| SCHEMBL11539861 | 0.75 | PPARD (0.32) | TSHRPPARD | |
| SCHEMBL15518677 | 0.75 | CYP1A2 (0.30) | — | |
| SCHEMBL15518678 | 0.75 | — | — | |
| Phosphoric Acid SCHEMBL31077974 | 0.74 | NAAA (0.53) | NAAAEPHX1HTTCYP2C19MMP1 | |
| SCHEMBL15519965 | 0.74 | PPARD (0.31) | TSHRPPARD | |
| SCHEMBL11682043 | 0.74 | CYP2C19 (0.49) | NAAAEPHX1HTTCYP2C19MMP1 | |
| SCHEMBL1536111 | 0.74 | MMP1 (0.43) | NAAAEPHX1MMP1MMP2TSHR | |
| SCHEMBL97374 | 0.73 | NAAA (0.60) | NAAAEPHX1HTTCYP2C19CYP19A1 |
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-2023125373-A1 | METHOD FOR PREPARING RUXOLITINIB AND INTERMEDIATE THEREOF | 江苏威凯尔医药科技有限公司 | 2023-07-06 | — | — | WO | disclosed |