Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KRAS | P01116 | 1/20 | 0.36 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ASPH | Q12797 | 1/20 | 0.34 |
| ▸ | RIOX2 | Q8IUF8 | 1/20 | 0.34 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17254694 | 1.00 | HTT (0.38) | HTTSMN1; SMN2CRHBPCRHR2MEN1 | |
| SCHEMBL20105148 | 0.87 | SLC6A4 (0.39) | HTTSMN1; SMN2CRHBPCRHR2MEN1 | |
| SCHEMBL17254682 | 0.87 | SLC6A4 (0.39) | HTTSMN1; SMN2CRHBPCRHR2MEN1 | |
| SCHEMBL20105186 | 0.85 | BRD4 (0.42) | HTTSMN1; SMN2CRHBPCRHR2MEN1 | |
| SCHEMBL17254695 | 0.85 | BRD4 (0.42) | HTTSMN1; SMN2CRHBPCRHR2MEN1 | |
| SCHEMBL17254681 | 0.77 | NUDT1 (0.38) | HTTSMN1; SMN2KMT2ANUDT1KDM4E | |
| SCHEMBL20105204 | 0.77 | NUDT1 (0.38) | HTTSMN1; SMN2KMT2ANUDT1KDM4E | |
| SCHEMBL13341324 | 0.76 | MPI (0.40) | MEN1KMT2ATP53 | |
| SCHEMBL16703654 | 0.76 | BRD4 (0.39) | MEN1KMT2AKRASSOS1BRD4 | |
| SCHEMBL17254700 | 0.76 | CRHBP (0.40) | HTTSMN1; SMN2CRHBPCRHR2MEN1 |
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 |