Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | CHIT1 | Q13231 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | FUCA1 | P04066 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | THPO | P40225 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL31050235 | 1.00 | CA2 (0.36) | CA2ALDH1A1TSHRCHIT1L3MBTL1 | |
| Trifluoroacetic Acid SCHEMBL2435717 | 0.87 | CA2 (0.40) | CA2ALDH1A1TSHRCHIT1L3MBTL1 | |
| Trifluoroacetic Acid SCHEMBL28336879 | 0.87 | CA2 (0.47) | CA2ALDH1A1TSHRCHIT1L3MBTL1 | |
| Trifluoroacetic Acid SCHEMBL1731636 | 0.83 | — | — | |
| Trifluoroacetic Acid SCHEMBL29615579 | 0.83 | ALDH1A1 (0.41) | CA2ALDH1A1TSHRL3MBTL1NOS1 | |
| Trifluoroacetic Acid SCHEMBL10587540 | 0.82 | DGAT1 (0.34) | CA2ALDH1A1TSHRL3MBTL1NOS1 | |
| Trifluoroacetic Acid SCHEMBL6576795 | 0.82 | ALDH1A1 (0.38) | CA2ALDH1A1TSHRL3MBTL1NOS1 | |
| Trifluoroacetic Acid SCHEMBL29695879 | 0.82 | CHIT1 (0.38) | CA2TSHRCHIT1NOS1NOS2 | |
| Trifluoroacetic Acid SCHEMBL6222069 | 0.81 | CA2 (0.36) | CA2ALDH1A1TSHRCHIT1L3MBTL1 | |
| Trifluoroacetic Acid SCHEMBL28996861 | 0.81 | CA2 (0.36) | CA2ALDH1A1TSHRCHIT1L3MBTL1 |
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-108129357-A | The preparation method of anamorelin intermediate | 上海医药工业研究院 | 2018-06-08 | — | — | CN | disclosed |