Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL8380669 | 0.81 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2ACHEHPGDGAA | |
| SCHEMBL1002849 | 0.81 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2ACHEHPGDGAA | |
| SCHEMBL1171649 | 0.80 | KMT2A (0.57) | ALDH1A1SMN1; SMN2HPGDGAACYP1A2 | |
| SCHEMBL1171653 | 0.80 | KMT2A (0.57) | ALDH1A1SMN1; SMN2HPGDGAACYP1A2 | |
| SCHEMBL11091013 | 0.80 | KMT2A (0.57) | ALDH1A1SMN1; SMN2HPGDGAACYP1A2 | |
| SCHEMBL27438744 | 0.79 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2ACHEHPGDGAA | |
| SCHEMBL842376 | 0.79 | AVPR2 (0.54) | ALDH1A1SMN1; SMN2ACHEHPGDKMT2A | |
| SCHEMBL7608298 | 0.79 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2ACHEHPGDGAA | |
| SCHEMBL21001982 | 0.76 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2ACHEHPGDGAA | |
| SCHEMBL5638260 | 0.74 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2ACHEHPGDGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995003421-A1 | PROCESS FOR THE ENZYMATIC PREPARATION OF OPTICALLY ACTIVE N-SUBSTITUTED-3-PYRROLIDINOL | DSM N.V. (NL) | 1995-02-02 | — | — | WO | disclosed |