Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 2/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 2/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | PRNP | P04156 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9739991 | 0.80 | NQO2 (0.39) | ERN1NQO2ALDH1A1 | |
| SCHEMBL4852222 | 0.75 | CYP3A4 (0.32) | — | |
| SCHEMBL9738931 | 0.73 | CYP19A1 (0.39) | BRD4NQO2ALDH1A1MAPTHTR2A | |
| SCHEMBL9741779 | 0.73 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL9740762 | 0.71 | CA2 (0.42) | NQO2ALDH1A1HTR2A | |
| SCHEMBL1966772 | 0.70 | CA1 (0.39) | ALOX15ALOX12NQO2ALDH1A1MAPT | |
| SCHEMBL2301175 | 0.67 | BRD4 (0.43) | ERN1ALOX15ALOX12BRD4NQO2 | |
| SCHEMBL9740846 | 0.66 | RXFP1 (0.38) | ERN1ALOX15ALOX12NQO2APP | |
| SCHEMBL9739481 | 0.66 | KDM4E (0.38) | NQO2MAPT | |
| SCHEMBL9741890 | 0.66 | CYP19A1 (0.38) | NQO2ALDH1A1MAPT |
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-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |