Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | MARK3 | P27448 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.33 |
| ▸ | ANPEP | P15144 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17254695 | 1.00 | BRD4 (0.42) | BRD4MARK3CRHBPCRHR2SLC6A4 | |
| SCHEMBL20105192 | 0.85 | HTT (0.38) | BRD4CRHBPCRHR2SLC6A4SLC6A2 | |
| SCHEMBL17254694 | 0.85 | HTT (0.38) | BRD4CRHBPCRHR2SLC6A4SLC6A2 | |
| SCHEMBL20105148 | 0.84 | SLC6A4 (0.39) | MARK3CRHBPCRHR2SLC6A4SLC6A2 | |
| SCHEMBL17254682 | 0.84 | SLC6A4 (0.39) | MARK3CRHBPCRHR2SLC6A4SLC6A2 | |
| SCHEMBL2486094 | 0.75 | AURKA (0.44) | BRD4MARK3MEN1KMT2ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL10696532 | 0.73 | AURKA (0.43) | BRD4MARK3MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL20105231 | 0.73 | MEN1 (0.38) | CRHBPCRHR2SLC6A4SLC6A2MEN1 | |
| SCHEMBL17254680 | 0.73 | MEN1 (0.38) | CRHBPCRHR2SLC6A4SLC6A2MEN1 | |
| SCHEMBL17254700 | 0.71 | CRHBP (0.40) | CRHBPCRHR2MEN1KMT2AHTT |
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-3140304-B1 | BENZIMIDAZOLE DERIVATIVES | BOEHRINGER INGELHEIM INT (DE) | 2018-05-02 | — | — | EP | disclosed |