Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | TNF | P01375 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | APAF1 | O14727 | 1/20 | 0.37 |
| ▸ | MITF | O75030 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30342198 | 0.72 | TP53 (0.52) | LMNAALDH1A1RECQLMEN1KMT2A | |
| SCHEMBL29005218 | 0.72 | TP53 (0.52) | LMNAALDH1A1RECQLMEN1KMT2A | |
| SCHEMBL4029880 | 0.71 | ALOX15 (0.50) | LMNAMAPTHTTNPSR1RECQL | |
| SCHEMBL29130643 | 0.70 | MAOB (0.72) | MAOBCYP1B1LMNAMAPTALDH1A1 | |
| SCHEMBL17916031 | 0.70 | DRD3 (0.52) | MAPTALDH1A1NPSR1RECQLMEN1 | |
| SCHEMBL12846303 | 0.67 | KMT2A (0.55) | LMNAMAPTMEN1KMT2ATNF | |
| SCHEMBL3462808 | 0.67 | ALDH1A1 (0.47) | MAOBCYP1B1LMNAMAPTALDH1A1 | |
| SCHEMBL3462807 | 0.67 | ALDH1A1 (0.47) | MAOBCYP1B1LMNAMAPTALDH1A1 | |
| SCHEMBL12845880 | 0.67 | KMT2A (0.55) | LMNAMAPTMEN1KMT2ATNF | |
| SCHEMBL15664132 | 0.66 | KMT2A (0.48) | ALDH1A1RECQLMEN1KMT2ATNF |
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 |
|---|---|---|---|---|---|---|---|
| EP-0045520-B1 | PYRIMIDO-(4,5-D)(2)-BENZAZEPINES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1984-06-20 | — | — | EP | disclosed |