Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACAT2 | Q9BWD1 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.31 |
| ▸ | CDK9 | P50750 | 1/20 | 0.31 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17757181 | 0.85 | ACAT2 (0.39) | ACAT2MEN1KMT2ACYP1A2CYP2C9 | |
| SCHEMBL17757720 | 0.83 | ACAT2 (0.39) | ACAT2MEN1KMT2ACYP1A2CYP2C9 | |
| SCHEMBL17757174 | 0.79 | ACAT2 (0.41) | ACAT2MEN1KMT2ACYP1A2ALDH1A1 | |
| SCHEMBL17757537 | 0.77 | DPP4 (0.39) | ACAT2CCNT1CDK9 | |
| SCHEMBL17757861 | 0.76 | DRD2 (0.37) | MEN1KMT2ACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL17757304 | 0.76 | ACAT2 (0.50) | ACAT2MEN1KMT2ACYP2C9CYP2C19 | |
| SCHEMBL17757171 | 0.76 | KDM1A (0.36) | ACAT2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL17757172 | 0.76 | ACAT2 (0.42) | ACAT2CYP1A2CYP2C9CYP2C19CCNT1 | |
| SCHEMBL17757370 | 0.76 | DRD2 (0.36) | ACAT2MEN1KMT2ACYP1A2CYP2C9 | |
| SCHEMBL17757523 | 0.75 | DRD2 (0.36) | MEN1KMT2ACYP1A2CYP2C9CYP2C19 |
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-RE48992-E1 | Spiroquinoxaline derivatives as inhibitors of non-apoptotic regulated cell-death | HELMHOLTZ ZENTRUM MÜNCHEN-DEUTSCHES FORSCHUNGSZENTRUM FÜR GESUNDHEIT UND UMWELT (GMBH) (DE) | 2022-03-29 | — | — | US | disclosed |