Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 2/20 | 0.52 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | RGS12 | O14924 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7636607 | 0.86 | ALDH1A1 (0.51) | GAAALDH1A1POLBMAPTLMNA | |
| SCHEMBL8734966 | 0.86 | GAA (0.56) | GAAALDH1A1GFERTDP1TSHR | |
| SCHEMBL30096935 | 0.83 | GAA (0.68) | ESR2ESR1GAAALDH1A1GFER | |
| SCHEMBL2127019 | 0.83 | GAA (0.68) | ESR2ESR1GAAALDH1A1GFER | |
| SCHEMBL8733751 | 0.81 | ESR1 (0.57) | ESR2ESR1GAAALDH1A1GFER | |
| SCHEMBL10732366 | 0.80 | HTT (0.48) | ALDH1A1TDP1TSHRKDM4EPOLB | |
| SCHEMBL28492275 | 0.78 | ESR1 (0.63) | ESR2ESR1GAAALDH1A1GFER | |
| SCHEMBL8870180 | 0.77 | FNTA (0.57) | ESR2ESR1GAAALDH1A1CA2 | |
| SCHEMBL7642353 | 0.77 | EGFR (0.49) | GAAALDH1A1TDP1LMNAHPGD | |
| SCHEMBL4023960 | 0.77 | ESR1 (0.61) | ESR2ESR1GAAALDH1A1GFER |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0696566-B1 | Process for production of phenyllactic acid derivative | NITTO CHEMICAL INDUSTRY CO LTD (JP) | 1998-06-10 | — | — | EP | disclosed |
| US-5684186-A | HYDROGENATION OF A PHENYLPYRUVIC DERIVATIVE | NITTO CHEMICAL INDUSTRY CO., LTD. (JP) | 1997-11-04 | — | — | US | disclosed |
| EP-0696566-A1 | Process for production of phenyllactic acid derivative | NITTO CHEMICAL INDUSTRY CO., LTD. (JP) | 1996-02-14 | — | — | EP | disclosed |