Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 11/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 11/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NQO1 | P15559 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19776413 | 0.76 | ACHE (0.37) | MTNR1AMTNR1BALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL19776415 | 0.71 | ALDH1A1 (0.40) | MTNR1AMTNR1BALDH1A1ELANE | |
| SCHEMBL20709817 | 0.70 | MTNR1A (0.50) | MTNR1AMTNR1BALDH1A1KDM4EELANE | |
| SCHEMBL2297648 | 0.70 | MTNR1A (0.53) | MTNR1AMTNR1BALDH1A1KDM4EELANE | |
| SCHEMBL15257484 | 0.70 | ELANE (0.41) | MTNR1AMTNR1BALDH1A1KDM4EELANE | |
| SCHEMBL24687752 | 0.69 | STAT3 (0.40) | ALDH1A1ELANENPC1MAPTMAPK1 | |
| SCHEMBL17281452 | 0.69 | ELANE (0.48) | MTNR1AMTNR1BALDH1A1KDM4EELANE | |
| SCHEMBL11932345 | 0.68 | MTNR1A (0.60) | MTNR1AMTNR1BALDH1A1KDM4EELANE | |
| SCHEMBL18133627 | 0.67 | ELANE (0.47) | MTNR1AMTNR1BALDH1A1KDM4EELANE | |
| SCHEMBL20669007 | 0.67 | ELANE (0.47) | MTNR1AMTNR1BALDH1A1KDM4EELANE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017119455-A1 | PROPHYLACTIC OR THERAPEUTIC AGENT FOR AUTISM SPECTRUM DISORDER | 武田薬品工業株式会社 | 2017-07-13 | — | — | WO | disclosed |
| WO-2017119456-A1 | PROPHYLACTIC OR THERAPEUTIC AGENT FOR DELIRIUM | 武田薬品工業株式会社 | 2017-07-13 | — | — | WO | disclosed |