Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28053811 | 0.88 | CYP3A4 (0.40) | CYP3A4CYP2C19ALDH1A1TRPA1TSHR | |
| SCHEMBL28826394 | 0.85 | CYP3A4 (0.39) | CYP3A4CYP2C19ALDH1A1TSHRHSD17B10 | |
| SCHEMBL28053818 | 0.81 | TRPA1 (0.52) | CYP3A4ALDH1A1TRPA1HSD17B10SMN1; SMN2 | |
| SCHEMBL28053841 | 0.79 | CYP3A4 (0.41) | CYP3A4CYP2C19ALDH1A1TSHRHSD17B10 | |
| SCHEMBL27948394 | 0.78 | CYP3A4 (0.43) | CYP3A4CYP2C19ALDH1A1TSHRHSD17B10 | |
| SCHEMBL28053720 | 0.77 | CYP3A4 (0.39) | CYP3A4CYP2C19ALDH1A1TSHRHSD17B10 | |
| SCHEMBL10676559 | 0.75 | CYP3A4 (0.51) | CYP3A4CYP2C19ALDH1A1TSHRHSD17B10 | |
| SCHEMBL14587548 | 0.75 | CYP3A4 (0.51) | CYP3A4CYP2C19ALDH1A1TSHRHSD17B10 | |
| SCHEMBL27579705 | 0.75 | PKM (0.48) | CYP3A4CYP2C19ALDH1A1TSHRHSD17B10 | |
| SCHEMBL2879781 | 0.72 | CYP3A4 (0.56) | CYP3A4CYP2C19ALDH1A1TSHRHSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103459467-B | Polybenzoxazole resin and precursor thereof | MITSUBISHI GAS CHEMICAL CO.,INC. (JP) | 2016-04-06 | — | — | CN | claimed |
| CN-103459467-B | Polybenzoxazole resin and precursor thereof | MITSUBISHI GAS CHEMICAL CO.,INC. (JP) | 2016-04-06 | — | — | CN | disclosed |