Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | BRD4 | O60885 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6597258 | 0.87 | KMT2A (0.48) | KMT2ABRD4ALDH1A1LMNAGFER | |
| SCHEMBL6595809 | 0.85 | TP53 (0.45) | KMT2ABRD4LMNATP53MEN1 | |
| SCHEMBL6600142 | 0.82 | TP53 (0.58) | KMT2ABRD4ALDH1A1LMNATP53 | |
| SCHEMBL6596456 | 0.81 | TP53 (0.54) | KMT2ABRD4ALDH1A1LMNATP53 | |
| SCHEMBL6596334 | 0.81 | LMNA (0.43) | KMT2ABRD4LMNATP53SMN1; SMN2 | |
| SCHEMBL6598401 | 0.81 | TP53 (0.45) | KMT2ABRD4ALDH1A1TP53PKM | |
| SCHEMBL6593732 | 0.81 | CYP1A2 (0.56) | LMNATP53GFERABCB1 | |
| SCHEMBL6596070 | 0.81 | L3MBTL1 (0.51) | KMT2ABRD4TP53SMN1; SMN2MEN1 | |
| SCHEMBL6596002 | 0.80 | TP53 (0.46) | KMT2ABRD4ALDH1A1LMNATP53 | |
| SCHEMBL6598880 | 0.76 | SMN1; SMN2 (0.41) | ALDH1A1SMN1; SMN2PKM |
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 |
|---|---|---|---|---|---|---|---|
| EP-0888338-A1 | NOVEL SUBSTITUTED N-METHYL-N-(4-(4-(1H-BENZIMIDAZOL-2-YL) 1,4]DIAZEPAN-1-YL)-2-(ARYL)BUTYL)BENZAMIDES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES | HOECHST MARION ROUSSEL, INC. (US) | 1999-01-07 | — | — | EP | disclosed |
| WO-1997030991-A1 | NOVEL SUBSTITUTED N-METHYL-N-(4-(4-(1H-BENZIMIDAZOL-2-YL)[1,4]DIAZEPAN-1-YL)-2-(ARYL)BUTYL)BENZAMIDES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES | HOECHST MARION ROUSSEL, INC. (US) | 1997-08-28 | — | — | WO | disclosed |