Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | FAAH | O00519 | 1/20 | 0.30 |
| ▸ | PHGDH | O43175 | 1/20 | 0.30 |
| ▸ | MGLL | Q99685 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL8076654 | 0.75 | MEN1 (0.37) | HTTKMT2AMEN1CA12CA1 | |
| SCHEMBL8076656 | 0.75 | MEN1 (0.37) | HTTKMT2AMEN1CA12CA1 | |
| SCHEMBL9238361 | 0.75 | MEN1 (0.37) | HTTKMT2AMEN1CA12CA1 | |
| SCHEMBL17436357 | 0.73 | MEN1 (0.41) | HTTKMT2AMEN1CA12CA1 | |
| SCHEMBL8559716 | 0.73 | MEN1 (0.41) | HTTKMT2AMEN1CA12CA1 | |
| SCHEMBL8559720 | 0.73 | MEN1 (0.41) | HTTKMT2AMEN1CA12CA1 | |
| SCHEMBL3155192 | 0.70 | ALDH1A1 (0.39) | HTTKMT2AMEN1CA12CA1 | |
| SCHEMBL6872360 | 0.70 | CA12 (0.37) | HTTKMT2AMEN1CA12CA1 | |
| SCHEMBL18812 | 0.70 | — | — | |
| Benzene SCHEMBL27358958 | 0.70 | ALDH1A1 (0.41) | HTTKMT2AMEN1CA12CA1 |
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-113620811-B | Halogenation method of aromatic compound | 中国科学院兰州化学物理研究所 | 2022-05-24 | — | — | CN | disclosed |