Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 3/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 9/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31084187 | 0.96 | HTR2A (0.46) | KDM1AMAOBHTR2ASIGMAR1TSHR | |
| SCHEMBL666915 | 0.81 | HTR2A (0.55) | KDM1AMAOBHTR2ASIGMAR1TSHR | |
| Hydrochloric Acid SCHEMBL30593071 | 0.79 | HTR2A (0.53) | KDM1AMAOBHTR2ASIGMAR1TSHR | |
| SCHEMBL31741763 | 0.79 | HTR2A (0.53) | KDM1AMAOBHTR2ASIGMAR1TSHR | |
| SCHEMBL29445683 | 0.74 | HTR2A (0.48) | KDM1AMAOBHTR2ASIGMAR1TSHR | |
| SCHEMBL30735764 | 0.72 | ALDH1A1 (0.33) | KDM1AMAOBHTR2ASIGMAR1TSHR | |
| SCHEMBL30735672 | 0.72 | ALDH1A1 (0.33) | KDM1AMAOBHTR2ASIGMAR1TSHR | |
| Phenol SCHEMBL5579811 | 0.71 | HTR2A (0.46) | KDM1AMAOBHTR2ASIGMAR1TSHR | |
| SCHEMBL19041309 | 0.70 | SIGMAR1 (0.58) | KDM1AMAOBSIGMAR1TSHRALDH1A1 | |
| SCHEMBL29860963 | 0.70 | SIGMAR1 (0.58) | KDM1AMAOBSIGMAR1TSHRALDH1A1 |
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-117430636-A | Chiral spiro phosphoramide compound and preparation method and application thereof | 南开大学 | 2024-01-23 | — | — | CN | disclosed |