Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18380898 | 0.88 | TDP1 (0.68) | TDP1CYP2D6EPHX1NPC1CA2 | |
| SCHEMBL7296555 | 0.84 | — | — | |
| SCHEMBL2392593 | 0.83 | CYP2D6 (0.53) | TDP1CYP2D6EPHX1NPC1CA2 | |
| SCHEMBL7296108 | 0.80 | TDP1 (0.82) | TDP1CYP2D6EPHX1NPC1CA2 | |
| SCHEMBL2285048 | 0.78 | TDP1 (0.78) | TDP1CYP2D6EPHX1NPC1CA2 | |
| SCHEMBL1050014 | 0.78 | TDP1 (0.78) | TDP1CYP2D6EPHX1NPC1CA2 | |
| SCHEMBL24015556 | 0.78 | EPHX1 (0.43) | TDP1CYP2D6EPHX1NPC1CA2 | |
| SCHEMBL12361378 | 0.77 | TDP1 (0.53) | TDP1CYP2D6EPHX1NPC1CA2 | |
| SCHEMBL9186900 | 0.77 | ALDH1A1 (0.39) | TDP1CYP2D6EPHX1NPC1CA2 | |
| SCHEMBL2000699 | 0.75 | — | — |
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-2022188203-A1 | IMIDAZOPYRIDINE DERIVATIVE | 北京富龙康泰生物技术有限公司 | 2022-09-15 | — | — | WO | disclosed |