Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 4/20 | 0.32 |
| ▸ | CES1 | P23141 | 4/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.30 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9919 | 0.97 | — | — | |
| SCHEMBL28163436 | 0.95 | NAAA (0.56) | NAAATSHRTHRBMEN1KMT2A | |
| SCHEMBL27517788 | 0.94 | NAAA (0.54) | NAAATSHRTHRBMEN1KMT2A | |
| Hexane SCHEMBL8984371 | 0.94 | NAAA (0.48) | NAAATSHRTHRBMEN1KMT2A | |
| SCHEMBL68026 | 0.94 | — | — | |
| Fluoride SCHEMBL28174258 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL8196526 | 0.94 | — | — | |
| SCHEMBL15486455 | 0.92 | NAAA (0.58) | NAAATSHRTHRBMEN1KMT2A | |
| SCHEMBL5575642 | 0.92 | NAAA (0.58) | NAAATSHRTHRBMEN1KMT2A | |
| SCHEMBL11589838 | 0.92 | — | — |
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-108117466-A | A kind of application of low burning rate high-energy HTPB propellant and alicyclic diisocyanate | 湖北航天化学技术研究所 | 2018-06-05 | — | — | CN | disclosed |