Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.32 |
| ▸ | MIF | P14174 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL15430 | 0.91 | CYP3A4 (0.70) | CYP3A4TSHRTDP1MAPK1TRPA1 | |
| SCHEMBL27995745 | 0.88 | TDP1 (0.52) | CYP3A4TSHRTDP1MAPK1TRPA1 | |
| SCHEMBL19876727 | 0.88 | CYP3A4 (0.50) | CYP3A4TSHRTDP1MAPK1TRPA1 | |
| SCHEMBL27741428 | 0.88 | CYP3A4 (0.67) | CYP3A4TSHRTDP1MAPK1TRPA1 | |
| Water SCHEMBL28889229 | 0.88 | CYP3A4 (0.67) | CYP3A4TSHRTDP1MAPK1TRPA1 | |
| Ammonia Solution, Strong SCHEMBL28239770 | 0.88 | CYP3A4 (0.67) | CYP3A4TSHRTDP1MAPK1TRPA1 | |
| SCHEMBL28583699 | 0.87 | CYP3A4 (0.48) | CYP3A4TSHRTDP1MAPK1TRPA1 | |
| SCHEMBL28893803 | 0.87 | CYP3A4 (0.48) | CYP3A4TSHRTDP1MAPK1TRPA1 | |
| SCHEMBL7984176 | 0.87 | CYP3A4 (0.48) | CYP3A4TSHRTDP1MAPK1TRPA1 | |
| SCHEMBL11061694 | 0.86 | CYP3A4 (0.65) | CYP3A4TSHRTDP1MAPK1TRPA1 |
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-107725601-B | A kind of preparation method of double-layer structure polyurethane composite bearing | 北华大学 | 2019-07-09 | — | — | CN | claimed |
| CN-112852378-B | Reactive polyurethane hot melt adhesive | 广东省京极盛新材料科技有限公司 | 2022-11-18 | — | — | CN | disclosed |