Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 3/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29041073 | 0.91 | HTR2C (0.51) | HTR2CDRD2HTR2AHTR2BMEN1 | |
| SCHEMBL19652158 | 0.81 | GRM5 (0.38) | HPGD | |
| SCHEMBL8954595 | 0.81 | SCN9A (0.47) | — | |
| SCHEMBL935859 | 0.80 | HTR2C (0.50) | HTR2CDRD2HTR2AHTR2BMEN1 | |
| SCHEMBL6484237 | 0.80 | HTR2C (0.50) | HTR2CDRD2HTR2AHTR2BMEN1 | |
| SCHEMBL29474981 | 0.80 | HTR2C (0.50) | HTR2CDRD2HTR2AHTR2BMEN1 | |
| SCHEMBL5801397 | 0.79 | HTR2C (0.46) | HTR2CDRD2HTR2AHTR2BMEN1 | |
| SCHEMBL23647777 | 0.79 | SCN9A (0.39) | DRD2TDP1 | |
| SCHEMBL29866266 | 0.79 | SCN9A (0.41) | DRD2TDP1MEN1KMT2A | |
| SCHEMBL8789291 | 0.77 | TUBB4A (0.43) | TDP1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118222538-B | Halohydrin dehalogenase mutant and application thereof | 南京工业大学 | 2024-09-20 | — | — | CN | disclosed |
| CN-118620972-A | Application of halohydrin dehalogenase in catalytic synthesis of chiral tetrahydrofuran compound | 南京工业大学 | 2024-09-10 | — | — | CN | disclosed |
| CN-118222538-A | Halohydrin dehalogenase mutant and application thereof | 南京工业大学 | 2024-06-21 | — | — | CN | disclosed |