Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.37 |
| ▸ | PLG | P00747 | 4/20 | 0.37 |
| ▸ | KLK1 | P06870 | 4/20 | 0.37 |
| ▸ | KLK6 | Q92876 | 4/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6204340 | 0.88 | NPSR1 (0.48) | TDP1NPSR1CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL27608898 | 0.83 | LOXL2 (0.43) | TDP1LOXL2NPSR1CYP3A4CYP2C19 | |
| SCHEMBL6203513 | 0.81 | NPSR1 (0.58) | NPSR1CYP3A4CYP2C19CYP1A2CYP2C9 | |
| SCHEMBL27608906 | 0.78 | CES2 (0.46) | TDP1LOXL2NPC1RAB9AALDH1A1 | |
| SCHEMBL6202201 | 0.74 | CES2 (0.41) | TDP1CYP3A4NPC1RAB9AALDH1A1 | |
| SCHEMBL6201259 | 0.74 | ALDH1A1 (0.47) | TDP1NPSR1CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL27608895 | 0.72 | ALDH1A1 (0.50) | LOXL2NPSR1CYP3A4CYP2C19CYP1A2 | |
| SCHEMBL27628071 | 0.72 | LOXL2 (0.43) | TDP1LOXL2NPC1RAB9AALDH1A1 | |
| SCHEMBL24327746 | 0.72 | KEAP1 (0.46) | NPSR1RAB9AALDH1A1LMNAL3MBTL1 | |
| SCHEMBL6203941 | 0.72 | NPSR1 (0.54) | TDP1NPSR1CYP3A4CYP2C19CYP1A2 |
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-1681763-A | Chemical compounds | ASTRAZENECA AB (SE) | 2005-10-12 | — | — | CN | disclosed |