Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 3/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | CTRC | Q99895 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7976230 | 0.96 | CTRC (0.38) | ALDH1A1CDC25BCA1CA2CA9 | |
| SCHEMBL7068104 | 0.92 | ALDH1A1 (0.40) | ALDH1A1CDC25BCA1CA2CA9 | |
| SCHEMBL7975992 | 0.92 | LMNA (0.47) | CA1CA2ELANECTRCLMNA | |
| SCHEMBL7973451 | 0.89 | CA1 (0.38) | ALDH1A1CA1CA2CA9MAPK1 | |
| SCHEMBL7969820 | 0.89 | LMNA (0.46) | CA1CA2ELANECTRCLMNA | |
| SCHEMBL7972830 | 0.86 | TDP1 (0.46) | ALDH1A1MAPK1L3MBTL1TDP1KMT2A | |
| SCHEMBL7971433 | 0.85 | FKBP1A (0.38) | ALDH1A1CA1CA2CA9MAPK1 | |
| SCHEMBL7972978 | 0.85 | KMT2A (0.40) | CA2CA9CA12MAPK1TDP1 | |
| SCHEMBL7064562 | 0.84 | LMNA (0.49) | ALDH1A1CA1CA2ELANELMNA | |
| SCHEMBL7973102 | 0.84 | TSHR (0.40) | ALDH1A1MAPK1L3MBTL1TDP1CTRC |
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 |