Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 8/20 | 0.36 |
| ▸ | HTT | P42858 | 6/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.36 |
| ▸ | MAPT | P10636 | 6/20 | 0.36 |
| ▸ | MEN1 | O00255 | 6/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | UBE2N | P61088 | 2/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 4/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.34 |
| ▸ | MIF | P14174 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14314495 | 0.79 | CYP1A2 (0.44) | CYP1A2CYP2C19CYP2D6HSD17B10NPSR1 | |
| SCHEMBL22650215 | 0.76 | ALDH1A1 (0.49) | CYP1A2CYP2C19CYP2D6HSD17B10NPSR1 | |
| SCHEMBL22650213 | 0.76 | KDM4E (0.55) | CYP1A2CYP2C19CYP2D6HSD17B10NPSR1 | |
| SCHEMBL17898140 | 0.76 | ALDH1A1 (0.48) | CYP1A2CYP2C19CYP2D6HSD17B10NPSR1 | |
| SCHEMBL16788840 | 0.75 | L3MBTL1 (0.57) | CYP1A2HSD17B10NPSR1MAPTMEN1 | |
| SCHEMBL19618911 | 0.74 | KDM4E (0.62) | CYP1A2CYP2C19CYP2D6HSD17B10NPSR1 | |
| SCHEMBL26655537 | 0.73 | SSTR4 (0.40) | CYP1A2CYP2C19CYP2D6HSD17B10NPSR1 | |
| SCHEMBL27773132 | 0.71 | ALDH1A1 (0.38) | CYP1A2CYP2C19CYP2D6HSD17B10NPSR1 | |
| SCHEMBL22650190 | 0.70 | MAPT (0.43) | CYP1A2CYP2C19CYP2D6HSD17B10NPSR1 | |
| SCHEMBL2945026 | 0.70 | CA1 (0.48) | HTTMAPK1MEN1KMT2AALDH1A1 |
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-2020225330-A1 | DHODH INHIBITORS AND THEIR USE AS ANTIVIRAL AGENTS | UNIVERSITÄT HAMBURG (DE) | 2020-11-12 | — | — | WO | disclosed |