Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 8/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | TGM2 | P21980 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.37 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ROS1 | P08922 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3736279 | 1.00 | CES1 (0.47) | CES1BCHETGM2MAPTMEN1 | |
| SCHEMBL3743988 | 0.80 | CES1 (0.50) | CES1BCHETGM2MAPTMEN1 | |
| SCHEMBL31728330 | 0.78 | CES1 (0.48) | CES1BCHETGM2MAPTMEN1 | |
| SCHEMBL29700199 | 0.77 | CES1 (0.47) | CES1TGM2MAPTMEN1POLB | |
| SCHEMBL15353216 | 0.77 | CES1 (0.47) | CES1TGM2MAPTMEN1POLB | |
| SCHEMBL2496190 | 0.77 | CES1 (0.67) | CES1BCHETGM2MAPTMEN1 | |
| SCHEMBL7827616 | 0.77 | MAPT (0.52) | CES1BCHETGM2MAPTMEN1 | |
| SCHEMBL6177499 | 0.77 | CES1 (0.67) | CES1BCHETGM2MAPTMEN1 | |
| SCHEMBL31103242 | 0.77 | CES1 (0.67) | CES1BCHETGM2MAPTMEN1 | |
| SCHEMBL7134014 | 0.76 | RET (0.48) | MAPTMEN1POLBBLMKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-118420516-A | Preparation method of halogenated indoline-2, 3-diketone compound | 河北医科大学 | 2024-08-02 | — | — | CN | disclosed |
| CN-117769443-A | Fibroblast activation protein inhibitor and use thereof | 3B制药有限公司 | 2024-03-26 | — | — | CN | disclosed |