Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | CRHBP | P24387 | 1/20 | 0.49 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.49 |
| ▸ | PAM | P19021 | 1/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.47 |
| ▸ | KLK7 | P49862 | 2/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 2/20 | 0.45 |
| ▸ | CES1 | P23141 | 2/20 | 0.45 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.45 |
| ▸ | ACE | P12821 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3395537 | 0.86 | TSHR (0.62) | TSHRALDH1A1MAPK1L3MBTL1CRHBP | |
| SCHEMBL3393812 | 0.86 | TSHR (0.62) | TSHRALDH1A1MAPK1L3MBTL1CRHBP | |
| SCHEMBL3276203 | 0.85 | TSHR (0.56) | TSHRALDH1A1MAPK1L3MBTL1CRHBP | |
| SCHEMBL1484827 | 0.84 | EPHX1 (0.46) | TSHRALDH1A1CRHBPCRHR2EPHX1 | |
| SCHEMBL9067637 | 0.83 | EPHX1 (0.52) | ALDH1A1CRHBPCRHR2EPHX1CYP1A2 | |
| SCHEMBL11845837 | 0.83 | EPHX1 (0.52) | ALDH1A1EPHX1CYP1A2ACESMN1; SMN2 | |
| SCHEMBL27726511 | 0.83 | EPHX1 (0.52) | ALDH1A1EPHX1CYP1A2SMN1; SMN2SRR | |
| SCHEMBL2637707 | 0.83 | ACE (0.53) | MAPK1EPHX1CYP1A2ACESMN1; SMN2 | |
| SCHEMBL4911331 | 0.81 | CRHBP (0.69) | TSHRALDH1A1MAPK1L3MBTL1CRHBP | |
| Hydrochloric Acid SCHEMBL11845834 | 0.81 | EPHX1 (0.50) | ALDH1A1EPHX1CYP1A2SMN1; SMN2SRR |
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-106715557-A9 | Monobenzoate analogs useful as plasticizers in plastisol compositions | 艾默罗德卡拉玛化学品公司 | 2017-08-25 | — | — | CN | disclosed |