Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | EDNRB | P24530 | 1/20 | 0.34 |
| ▸ | EDNRA | P25101 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 2/20 | 0.33 |
| ▸ | CTSA | P10619 | 2/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.32 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.32 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.32 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28167424 | 0.88 | NPC1 (0.33) | ALDH1A1CNR1CNR2MEN1KMT2A | |
| SCHEMBL28167440 | 0.86 | AKR1C3 (0.40) | EDNRBEDNRACTSAAKR1C3AKR1C2 | |
| SCHEMBL9712243 | 0.73 | MCL1 (0.41) | MCL1NR1H4EDNRBEDNRACA12 | |
| SCHEMBL11641774 | 0.68 | CNR1 (0.54) | ALDH1A1CNR1CNR2MEN1KMT2A | |
| SCHEMBL374592 | 0.66 | MCL1 (0.45) | MCL1NR1H4EDNRBEDNRAALDH1A1 | |
| Acetone SCHEMBL8119850 | 0.64 | STAT3 (0.42) | ALDH1A1CNR1CNR2MEN1KMT2A | |
| SCHEMBL10595614 | 0.64 | MCL1 (0.42) | MCL1NR1H4CNR1FTOCA12 | |
| SCHEMBL8125021 | 0.64 | MCL1 (0.42) | MCL1NR1H4EDNRBEDNRACA12 | |
| SCHEMBL15638352 | 0.64 | MCL1 (0.42) | MCL1NR1H4EDNRBEDNRAALDH1A1 | |
| Toluene SCHEMBL27419686 | 0.63 | MEN1 (0.50) | ALDH1A1CNR1CNR2MEN1KMT2A |
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-105330522-B | Preparation method of benzo [ b ] fluorenone series compounds | 江西师范大学 | 2017-08-08 | — | — | CN | disclosed |