Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.71 |
| ▸ | ACHE | P22303 | 3/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA7 | P43166 | 2/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | TDP2 | O95551 | 1/20 | 0.38 |
| ▸ | NSD2 | O96028 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| O-Xylene SCHEMBL9614971 | 0.94 | TSHR (0.62) | TSHRACHECYP1A2CYP2A6TRPA1 | |
| O-Xylene SCHEMBL8979417 | 0.88 | ACHE (0.61) | TSHRACHECYP1A2CYP2A6TRPA1 | |
| O-Xylene SCHEMBL3835918 | 0.86 | TSHR (0.71) | TSHRACHECYP1A2CYP2A6TRPA1 | |
| SCHEMBL4071459 | 0.86 | TRPA1 (0.55) | TSHRACHECYP1A2CYP2A6TRPA1 | |
| SCHEMBL5494672 | 0.84 | TSHR (0.45) | TSHRACHECYP1A2CYP2A6TRPA1 | |
| O-Xylene SCHEMBL10522915 | 0.84 | TSHR (1.00) | TSHRACHECYP1A2CYP2A6TRPA1 | |
| O-Xylene SCHEMBL2854068 | 0.84 | — | — | |
| O-Xylene SCHEMBL11034038 | 0.84 | TSHR (1.00) | TSHRACHECYP1A2CYP2A6TRPA1 | |
| O-Xylene SCHEMBL8216257 | 0.84 | TSHR (1.00) | TSHRACHECYP1A2CYP2A6TRPA1 | |
| O-Xylene SCHEMBL772 | 0.84 | — | — |
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-108164992-A | Heat conductive rubber material and preparation method thereof and heat conductive rubber piece | 昆山市中迪新材料技术有限公司 | 2018-06-15 | — | — | CN | disclosed |