Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11191632 | 0.82 | CYP1A2 (0.38) | CYP1A2TSHRMAPTKMT2AKCNN4 | |
| SCHEMBL976610 | 0.79 | CYP1A2 (0.52) | CYP1A2TSHRMAPTKMT2AKCNN4 | |
| SCHEMBL226184 | 0.78 | CYP1A2 (0.56) | CYP1A2TSHRMAPTKMT2AKCNN4 | |
| SCHEMBL11028286 | 0.77 | CYP1A2 (0.50) | CYP1A2TSHRMAPTKMT2AKCNN4 | |
| SCHEMBL28069521 | 0.77 | CYP1A2 (0.50) | CYP1A2TSHRMAPTKMT2AKCNN4 | |
| SCHEMBL1321231 | 0.77 | CYP1A2 (0.70) | CYP1A2TSHRMAPTKMT2AKCNN4 | |
| SCHEMBL3086830 | 0.77 | CYP1A2 (0.56) | CYP1A2TSHRMAPTKMT2AKCNN4 | |
| SCHEMBL21269074 | 0.76 | CYP1A2 (0.54) | CYP1A2TSHRMAPTKMT2AKCNN4 | |
| SCHEMBL21269593 | 0.76 | CYP1A2 (0.54) | CYP1A2TSHRMAPTKMT2AKCNN4 | |
| SCHEMBL21269337 | 0.76 | CYP1A2 (0.54) | CYP1A2TSHRMAPTKMT2AKCNN4 |
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-111801355-A | Polymer material and method for producing same | 国立大学法人大阪大学 | 2020-10-20 | — | — | CN | disclosed |