Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 4/20 | 0.32 |
| ▸ | CES1 | P23141 | 4/20 | 0.32 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.32 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.32 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 6/20 | 0.30 |
| ▸ | PPARD | Q03181 | 6/20 | 0.30 |
| ▸ | PPARA | Q07869 | 6/20 | 0.30 |
| ▸ | GPR84 | Q9NQS5 | 5/20 | 0.30 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.30 |
| ▸ | TLR2 | O60603 | 2/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.30 |
| ▸ | FABP4 | P15090 | 2/20 | 0.30 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.30 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.30 |
| ▸ | SLC22A8 | Q8TCC7 | 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 | |
|---|---|---|---|---|
| SCHEMBL21882660 | 0.94 | ALDH1A1 (0.37) | TSHRALDH1A1CES2CES1TP53 | |
| SCHEMBL24092186 | 0.86 | TSHR (0.32) | TSHR | |
| SCHEMBL18998415 | 0.80 | TSHR (0.35) | TSHRALDH1A1FAAHCES2CES1 | |
| SCHEMBL21277524 | 0.79 | TSHR (0.43) | TSHRALDH1A1CES2CES1AKR1B1 | |
| SCHEMBL18626686 | 0.78 | TSHR (0.38) | TSHRALDH1A1FAAHCES2CES1 | |
| SCHEMBL21648897 | 0.74 | FAAH (0.35) | TSHRFAAHCES2CES1ZDHHC20 | |
| SCHEMBL27686509 | 0.73 | CES1 (0.43) | TSHRALDH1A1CES2CES1AKR1B1 | |
| SCHEMBL29313073 | 0.73 | ZDHHC20 (0.33) | TSHRFAAHZDHHC20ZDHHC2 | |
| SCHEMBL20382710 | 0.72 | TSHR (0.34) | TSHRALDH1A1FAAHTP53TDP1 | |
| SCHEMBL23555030 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3445743-B1 | PRODRUG OF AMINO ACID DERIVATIVE | TAISHO PHARMACEUTICAL CO LTD (JP) | 2021-08-04 | — | — | EP | disclosed |