Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL7971288 | 0.95 | HCAR2 (0.48) | HCAR2ESR1ESR2LMNATDP1 | |
| SCHEMBL7067254 | 0.91 | HCAR2 (0.47) | HCAR2ESR1ESR2LMNATDP1 | |
| SCHEMBL7969600 | 0.84 | ALDH1A1 (0.51) | HCAR2LMNATDP1L3MBTL1ALDH1A1 | |
| SCHEMBL7973137 | 0.80 | ALDH1A1 (0.50) | HCAR2LMNATDP1L3MBTL1ALDH1A1 | |
| SCHEMBL27842608 | 0.79 | HCAR2 (0.54) | HCAR2ESR1ESR2LMNATDP1 | |
| SCHEMBL7976235 | 0.76 | TDP1 (0.42) | TDP1NPC1RAB9AL3MBTL1SMN1; SMN2 | |
| SCHEMBL9662484 | 0.76 | HCAR2 (0.51) | HCAR2ESR1ESR2LMNATDP1 | |
| SCHEMBL27860102 | 0.76 | HCAR2 (0.51) | HCAR2ESR1ESR2LMNATDP1 | |
| SCHEMBL29232860 | 0.74 | TSHR (0.58) | HCAR2ESR1ESR2LMNATDP1 | |
| SCHEMBL7066136 | 0.74 | ALDH1A1 (0.55) | HCAR2LMNATDP1L3MBTL1SMN1; SMN2 |
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 |