Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | CCKBR | P32239 | 15/20 | 0.53 |
| ▸ | CCKAR | P32238 | 11/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16777948 | 0.84 | NOTCH1 (0.49) | MEN1ALDH1A1KMT2ACCKBRCCKAR | |
| SCHEMBL16777944 | 0.84 | CCKBR (0.40) | MEN1ALDH1A1KMT2ACCKBRCCKAR | |
| SCHEMBL16777947 | 0.84 | NOTCH1 (0.49) | MEN1ALDH1A1KMT2ACCKBRCCKAR | |
| SCHEMBL16777930 | 0.83 | MEN1 (0.44) | MEN1ALDH1A1KMT2ACCKBRCCKAR | |
| SCHEMBL16777950 | 0.82 | NOTCH1 (0.51) | MEN1ALDH1A1KMT2ACCKBRCCKAR | |
| SCHEMBL24612375 | 0.78 | CCKBR (0.51) | MEN1ALDH1A1KMT2ACCKBRCCKAR | |
| SCHEMBL8741334 | 0.78 | CCKBR (0.58) | MEN1ALDH1A1KMT2ACCKBRCCKAR | |
| SCHEMBL15608190 | 0.77 | NOTCH1 (0.51) | CCKBRCCKAR | |
| SCHEMBL15608191 | 0.77 | NOTCH1 (0.51) | CCKBRCCKAR | |
| SCHEMBL24611851 | 0.77 | CCKBR (0.53) | MEN1ALDH1A1KMT2ACCKBRCCKAR |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993008175-A1 | BENZODIAZEPINE DERIVATIVES AS ANTAGONISTS OF GASTRIN AND/OR CHOLECYSTOKININ | GLAXO GROUP LIMITED (GB) | 1993-04-29 | — | — | WO | disclosed |
| EP-0538945-A1 | Benzodiazepine derivatives, and their use as antagonists of gastrin and/or cholecystokinin | GLAXO GROUP LIMITED (GB) | 1993-04-28 | — | — | EP | disclosed |