Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 6/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.49 |
| ▸ | TOP1 | P11387 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | TERT | O14746 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYCS | P99999 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2531376 | 0.85 | TERT (0.49) | CYP2D6CYP19A1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL12190732 | 0.85 | TERT (0.49) | CYP2D6CYP19A1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL8031578 | 0.85 | TERT (0.49) | CYP2D6CYP19A1CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL27793465 | 0.83 | TOP1 (0.47) | TOP1TERTCYCSSTAT3STAT1 | |
| SCHEMBL28327434 | 0.82 | ALDH1A1 (0.46) | CYP2D6CYP3A4TOP1CYP1A2TERT | |
| SCHEMBL27814700 | 0.81 | TOP1 (0.48) | TOP1TERTMAPTKDM4EL3MBTL1 | |
| SCHEMBL12633085 | 0.81 | TERT (0.47) | CYP3A4TOP1TERTSMN1; SMN2ALDH1A1 | |
| SCHEMBL6843058 | 0.81 | CYP1A2 (0.48) | CYP2D6CYP19A1CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL12668273 | 0.80 | TSHR (0.41) | CYP19A1CYP2C9CYP2C19CYP1A2TERT | |
| SCHEMBL586280 | 0.80 | NR5A1 (0.57) | TOP1TERTCYCSLTA4H |
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-104667883-A | Preparation method of material for detecting and adsorbing ferrous ions and copper ions in water body simultaneously | UNIV NANCHANG HANGKONG | 2015-06-03 | — | — | CN | disclosed |