Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | SNCA | P37840 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1389429 | 0.82 | CYP3A4 (0.86) | CYP3A4TSHRHDAC6KMT2AMEN1 | |
| SCHEMBL30026816 | 0.82 | CYP3A4 (0.86) | CYP3A4TSHRHDAC6KMT2AMEN1 | |
| SCHEMBL13302358 | 0.80 | CYP3A4 (0.82) | CYP3A4TSHRHDAC6KMT2AMEN1 | |
| SCHEMBL4785787 | 0.78 | FADS1 (0.45) | KMT2AMEN1ALDH1A1CYP1A2MAPT | |
| SCHEMBL1920769 | 0.78 | CYP3A4 (0.86) | CYP3A4TSHRHDAC6KMT2AMEN1 | |
| SCHEMBL3185782 | 0.77 | CYP2A6 (0.36) | TSHRALDH1A1ALOX15ALOX12MAPK1 | |
| SCHEMBL219995 | 0.76 | CYP3A4 (1.00) | CYP3A4TSHRHDAC6KMT2AMEN1 | |
| SCHEMBL29678179 | 0.76 | CYP3A4 (1.00) | CYP3A4TSHRHDAC6KMT2AMEN1 | |
| SCHEMBL3038796 | 0.76 | HSD17B10 (0.57) | CYP3A4TSHRKMT2AMEN1ALDH1A1 | |
| SCHEMBL8352093 | 0.74 | CYP3A4 (0.79) | CYP3A4TSHRHDAC6KMT2AMEN1 |
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-102971327-B | There is the anti-inflammatory compound of multiple tyrosine-kinase enzyme inhibition activity and the pharmaceutical compositions containing these compounds | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2016-04-20 | — | — | CN | disclosed |