Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.43 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.43 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.38 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | GLS | O94925 | 1/20 | 0.36 |
| ▸ | CDC25B | P30305 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
| ▸ | TERT | O14746 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL487827 | 0.83 | POLB (0.48) | CYP1A2POLBCASP3EHMT2EHMT1 | |
| SCHEMBL28503423 | 0.80 | POLB (0.46) | CYP1A2POLBCASP3EHMT2EHMT1 | |
| SCHEMBL5454877 | 0.73 | CASP3 (0.59) | DPP4NR1H2NR1H3CYP1A2POLB | |
| SCHEMBL6135716 | 0.73 | CES1 (0.47) | CYP1A2POLBCASP3EHMT2EHMT1 | |
| SCHEMBL8045796 | 0.73 | CES1 (0.47) | DPP4NR1H2NR1H3CYP1A2POLB | |
| SCHEMBL11836683 | 0.71 | KMT2A (0.59) | DPP4NR1H2NR1H3KMT2AMEN1 | |
| SCHEMBL11843816 | 0.71 | CA12 (0.48) | CASP3KMT2AMEN1CA12CA9 | |
| SCHEMBL11845945 | 0.71 | GLS (0.53) | CASP3CA12CA9GLSKDM4E | |
| SCHEMBL11844877 | 0.70 | NR1H3 (0.53) | DPP4NR1H2NR1H3POLBKMT2A | |
| SCHEMBL20422074 | 0.70 | DPP4 (0.41) | DPP4NR1H2NR1H3CYP1A2POLB |
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-2020224396-A1 | COMPOUNDS INHIBITING TDG ACTIVITY | 上海仕谱生物科技有限公司 | 2020-11-12 | — | — | WO | disclosed |