Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.76 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.76 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.76 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.69 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.69 |
| ▸ | TP53 | P04637 | 1/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.67 |
| ▸ | LMNA | P02545 | 1/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
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 SCHEMBL27724413 | 0.94 | ALDH1A1 (0.77) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Benzene SCHEMBL3679548 | 0.94 | TSHR (0.86) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Phthalic Acid SCHEMBL27849166 | 0.94 | TSHR (0.86) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| SCHEMBL151027 | 0.94 | TSHR (0.86) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Dibutyl Phthalate SCHEMBL2220638 | 0.94 | TSHR (0.86) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| SCHEMBL29649180 | 0.94 | TSHR (0.86) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Dibutyl Phthalate SCHEMBL27849163 | 0.94 | TSHR (0.86) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Dibutyl Phthalate SCHEMBL753014 | 0.94 | TSHR (0.86) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| SCHEMBL10623274 | 0.92 | TSHR (0.78) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| SCHEMBL11206095 | 0.92 | TSHR (0.83) | TSHRTDP1L3MBTL1CYP3A4MAPK1 |
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-104861592-A | Antioxidant plastic container allowing long-term storage | ANHUI JIAYI LEISURE PRODUCTS CO LTD | 2015-08-26 | — | — | CN | disclosed |