Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC20 | Q12834 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | GLA | P06280 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | GUSB | P08236 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 8/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28462602 | 0.92 | CDC20 (0.60) | CDC20ALDH1A1KMT2AMEN1THRB | |
| SCHEMBL28455540 | 0.88 | CDC20 (0.67) | CDC20ALDH1A1KMT2AMEN1THRB | |
| SCHEMBL30082815 | 0.81 | CDC20 (0.44) | CDC20ALDH1A1ATMMAPTLMNA | |
| SCHEMBL28937287 | 0.77 | ALDH1A1 (0.55) | CDC20ALDH1A1KMT2AMEN1THRB | |
| SCHEMBL28457230 | 0.74 | CDC20 (0.59) | CDC20ALDH1A1KMT2AMEN1THRB | |
| SCHEMBL30082817 | 0.74 | SERPINA3 (0.41) | CDC20ALDH1A1KMT2AMEN1ATM | |
| SCHEMBL30082822 | 0.71 | CDC20 (0.45) | CDC20ALDH1A1MAPTLMNA | |
| SCHEMBL17264260 | 0.70 | ALDH1A1 (0.76) | CDC20ALDH1A1KMT2AMEN1THRB | |
| SCHEMBL28937292 | 0.70 | CDC20 (0.45) | CDC20ALDH1A1KMT2AMEN1THRB | |
| SCHEMBL28465271 | 0.70 | CDC20 (0.41) | CDC20ALDH1A1KMT2AMEN1THRB |
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-111606891-B | (1,1,1-trichloro-2) carbamate derivative and preparation method and application thereof | 中南大学 | 2023-01-17 | — | — | CN | disclosed |
| CN-111606891-A | (1,1, 1-trichloro-2) carbamate derivative and preparation method and application thereof | 中南大学 | 2020-09-01 | — | — | CN | disclosed |