Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.39 |
| ▸ | PPARG | P37231 | 7/20 | 0.39 |
| ▸ | PPARD | Q03181 | 7/20 | 0.39 |
| ▸ | PPARA | Q07869 | 7/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TLR2 | O60603 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | FABP4 | P15090 | 2/20 | 0.39 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.39 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7150979 | 0.83 | MEN1 (0.46) | MEN1KMT2ACES2MAPTATM | |
| SCHEMBL30441966 | 0.80 | CES2 (0.42) | MEN1KMT2ACES2GPR84PPARG | |
| SCHEMBL29563460 | 0.80 | CES2 (0.42) | MEN1KMT2ACES2GPR84PPARG | |
| SCHEMBL8775273 | 0.80 | CETP (0.47) | MEN1KMT2AL3MBTL1PPARGPPARA | |
| SCHEMBL10944911 | 0.79 | FAAH (0.47) | MEN1KMT2ACES2GPR84PPARG | |
| SCHEMBL9257689 | 0.79 | SMPD1 (0.41) | MEN1KMT2ACES2MAPTATM | |
| SCHEMBL28492858 | 0.79 | SMPD1 (0.41) | MEN1KMT2ACES2MAPTATM | |
| SCHEMBL8682806 | 0.79 | MEN1 (0.39) | MEN1KMT2ACES2MAPTATM | |
| SCHEMBL28497128 | 0.79 | GAA (0.48) | MEN1KMT2ACES2MAPTATM | |
| SCHEMBL28492857 | 0.79 | SMPD1 (0.41) | MEN1KMT2ACES2MAPTATM |
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-107261148-B | Methylphenidate prodrugs, methods of making and using the same | 凯姆制药公司 | 2021-07-13 | — | — | CN | disclosed |