Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 9/20 | 0.50 |
| ▸ | NAMPT | P43490 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.43 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.43 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.43 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.43 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.43 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.43 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.42 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27810920 | 0.81 | BCHE (0.61) | BCHERAB9AALDH1A1KCNA3F2 | |
| SCHEMBL27923505 | 0.80 | BCHE (0.57) | BCHEALDH1A1 | |
| SCHEMBL27652150 | 0.79 | HDAC3 (0.60) | BCHERAB9AALDH1A1KCNA3F2 | |
| SCHEMBL27742584 | 0.79 | F2 (0.63) | BCHERAB9AALDH1A1KCNA3F2 | |
| SCHEMBL29286125 | 0.78 | BCHE (0.46) | BCHEALDH1A1KCNA3 | |
| SCHEMBL28576382 | 0.78 | BCHE (0.46) | BCHEALDH1A1KCNA3 | |
| SCHEMBL27630590 | 0.77 | HDAC3 (0.62) | BCHERAB9AALDH1A1KCNA3F2 | |
| SCHEMBL27709635 | 0.76 | BCHE (0.59) | BCHEALDH1A1KCNA3F2PRSS1 | |
| SCHEMBL16369737 | 0.76 | TSHR (0.59) | BCHEALDH1A1 | |
| SCHEMBL27557534 | 0.76 | MC4R (0.59) | BCHEALDH1A1 |
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-102516115-B | As the antagonist of Opioid Receptors or the new compound of inverse agonist | SMITHKLINE BEECHAN CORP. (US) | 2016-05-11 | — | — | CN | disclosed |