Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | LAP3 | P28838 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7973137 | 0.95 | ALDH1A1 (0.50) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL7066136 | 0.90 | ALDH1A1 (0.55) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL8784388 | 0.88 | ALDH1A1 (0.60) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL11200640 | 0.85 | MMP1 (0.49) | TDP1L3MBTL1LMNA | |
| SCHEMBL7972770 | 0.84 | HCAR2 (0.49) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL28279334 | 0.83 | CETP (0.51) | ALDH1A1TDP1MAPK1L3MBTL1KMT2A | |
| SCHEMBL10399514 | 0.83 | ALDH1A1 (0.58) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL7332726 | 0.82 | ALDH1A1 (0.53) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 | |
| SCHEMBL11829944 | 0.80 | MMP12 (0.52) | ALDH1A1KMT2ALMNAHTTTSHR | |
| SCHEMBL7971288 | 0.80 | HCAR2 (0.48) | ALDH1A1HCAR2TDP1MAPK1L3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6172234-B1 | Optically active cyclic amino acid ester derivatives and processes for producing the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2001-01-09 | — | — | US | disclosed |
| EP-0976729-A1 | Optically active cyclic amino acid ester derivatives and processes for producing the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-02-02 | — | — | EP | disclosed |