Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CES2 | O00748 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15297890 | 0.80 | CES1 (0.44) | CES1ALDH1A1CES2TSHRDAO | |
| SCHEMBL15297897 | 0.78 | ALDH1A1 (0.46) | CES1ALDH1A1CES2TSHRDAO | |
| SCHEMBL15297887 | 0.77 | HPGD (0.49) | CES1ALDH1A1CES2TSHRDAO | |
| SCHEMBL6960130 | 0.77 | ALDH1A1 (0.45) | CES1ALDH1A1CES2TSHRDAO | |
| SCHEMBL15297896 | 0.75 | ALDH1A1 (0.51) | CES1ALDH1A1CES2TSHRDAO | |
| SCHEMBL15297906 | 0.75 | ALDH1A1 (0.40) | CES1ALDH1A1CES2TSHRDAO | |
| SCHEMBL7338845 | 0.74 | CA2 (0.43) | CES1ALDH1A1CES2TSHRDAO | |
| SCHEMBL15297925 | 0.74 | ALDH1A1 (0.42) | CES1ALDH1A1CES2TSHRDAO | |
| SCHEMBL15297891 | 0.72 | ALDH1A1 (0.45) | CES1ALDH1A1CES2TSHRDAO | |
| SCHEMBL15297895 | 0.71 | ALDH1A1 (0.47) | CES1ALDH1A1CES2HPGDKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-20020106763-A1 | PROCESS FOR PREPARING OPTICALLY ACTIVE 3-HYDROXY-PYRROLIDINE DERIVATIVES BY ENZYMATIC HYDROXYLATION | EIDGENOSSISCHE TECHNISCHE HOCHSCHULE ZURICH (CH) | 2002-08-08 | — | — | US | disclosed |