Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 8/20 | 0.47 |
| ▸ | CDK2 | P24941 | 4/20 | 0.42 |
| ▸ | TGM2 | P21980 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 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 |
| ▸ | USP8 | P40818 | 1/20 | 0.36 |
| ▸ | USP7 | Q93009 | 1/20 | 0.36 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.36 |
| ▸ | CCNE1 | P24864 | 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 | |
|---|---|---|---|---|
| SCHEMBL15353216 | 1.00 | CES1 (0.47) | CES1CDK2TGM2MEN1POLB | |
| SCHEMBL4586111 | 0.82 | CES1 (0.52) | CES1CDK2TGM2MEN1POLB | |
| SCHEMBL3743988 | 0.80 | CES1 (0.50) | CES1TGM2MEN1POLBMAPT | |
| SCHEMBL3531791 | 0.78 | CES1 (0.48) | CES1CDK2TGM2MEN1POLB | |
| SCHEMBL3736279 | 0.77 | CES1 (0.47) | CES1TGM2MEN1POLBMAPT | |
| SCHEMBL30838472 | 0.77 | CES1 (0.47) | CES1TGM2MEN1POLBMAPT | |
| SCHEMBL2496190 | 0.77 | CES1 (0.67) | CES1TGM2MEN1POLBMAPT | |
| SCHEMBL2372330 | 0.77 | CES1 (0.67) | CES1CDK2TGM2MEN1POLB | |
| SCHEMBL29700081 | 0.77 | CES1 (0.47) | CES1CDK2TGM2MEN1POLB | |
| SCHEMBL29700102 | 0.77 | ALDH1A1 (0.44) | CES1CDK2TGM2MEN1POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-114685395-A | 2, 3-dihydrobenzo [ d ] isothiazole compound and application thereof | 浙江大学 | 2022-07-01 | — | — | CN | disclosed |