Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 13/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.34 |
| ▸ | PDE9A | O76083 | 2/20 | 0.33 |
| ▸ | CTSC | P53634 | 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 | |
|---|---|---|---|---|
| SCHEMBL9365324 | 0.82 | KDM4E (0.38) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL9368415 | 0.78 | GRIA1 (0.39) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL9364703 | 0.76 | KDM4E (0.35) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL9364648 | 0.76 | GRIA1 (0.43) | KDM4E | |
| SCHEMBL9365049 | 0.75 | GRIA1 (0.39) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL9091900 | 0.75 | GRIA1 (0.40) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL9080817 | 0.74 | SMN1; SMN2 (0.45) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL9365208 | 0.74 | GRIA2 (0.39) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL9364647 | 0.74 | GRIA1 (0.41) | ALDH1A1AR | |
| SCHEMBL9364643 | 0.72 | GRIA1 (0.38) | KDM4EALDH1A1GLAGAAHPGD |
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-0377112-B1 | Quinoxaline compounds and their preparation and use | NOVO NORDISK AS (DK) | 1994-08-24 | — | — | EP | disclosed |
| US-5061706-A | 2,3-QUINOXALINEDIONES FOR USE AS NEUROLEPTICS | NOVO NORDISK A/S (DK) | 1991-10-29 | — | — | US | disclosed |
| EP-0377112-A1 | Quinoxaline compounds and their preparation and use | NOVO NORDISK A/S (DK) | 1990-07-11 | — | — | EP | disclosed |