Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15746313 | 0.85 | AAK1 (0.74) | AAK1HDAC1HDAC2HDAC3KMT2A | |
| SCHEMBL24969552 | 0.80 | KMT2A (0.55) | HDAC1HDAC2HDAC3KMT2APOLB | |
| SCHEMBL30152391 | 0.80 | KMT2A (0.55) | HDAC1HDAC2HDAC3KMT2APOLB | |
| SCHEMBL15111081 | 0.78 | AAK1 (0.61) | AAK1HDAC1HDAC2HDAC3KMT2A | |
| SCHEMBL20096319 | 0.76 | KDM4E (0.41) | AAK1HDAC1HDAC2MAPT | |
| SCHEMBL7604703 | 0.76 | HDAC1 (0.63) | AAK1HDAC1HDAC2HDAC3 | |
| SCHEMBL15594368 | 0.76 | KMT2A (0.68) | AAK1KMT2APOLBALDH1A1ABL1 | |
| SCHEMBL18496269 | 0.75 | ABL1 (0.41) | AAK1ABL1 | |
| SCHEMBL18496263 | 0.75 | ABL1 (0.39) | AAK1KMT2APOLBALDH1A1ABL1 | |
| SCHEMBL18496295 | 0.75 | ABL1 (0.41) | AAK1ABL1 |
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-3334719-B1 | SUBSTITUTED BENZIMIDAZOLES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS | NEOMED INST (CA) | 2021-09-15 | — | — | EP | disclosed |
| WO-2017024412-A1 | SUBSTITUTED BENZIMIDAZOLES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS | NEOMED INSTITUTE (CA) | 2017-02-16 | — | — | WO | disclosed |