Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.80 |
| ▸ | CNR1 | P21554 | 15/20 | 0.74 |
| ▸ | NPC1 | O15118 | 1/20 | 0.67 |
| ▸ | RAB9A | P51151 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.67 |
| ▸ | MEN1 | O00255 | 2/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | LMNA | P02545 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL4912471 | 0.89 | KMT2A (1.00) | KMT2ACNR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL13182416 | 0.87 | KMT2A (0.64) | KMT2ACNR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29615039 | 0.85 | CNR1 (1.00) | KMT2ACNR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL22834003 | 0.85 | CNR1 (1.00) | KMT2ACNR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL22834158 | 0.85 | CNR1 (1.00) | KMT2ACNR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29615017 | 0.85 | CNR1 (1.00) | KMT2ACNR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL22834228 | 0.82 | CNR1 (1.00) | KMT2ACNR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29614969 | 0.82 | CNR1 (1.00) | KMT2ACNR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4966285 | 0.82 | KMT2A (0.79) | KMT2ACNR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL22834255 | 0.81 | CNR1 (1.00) | KMT2ACNR1NPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014028931-A2 | COMPOUNDS AND METHODS FOR TREATING MAMMALIAN GASTROINTESTINAL MICROBIAL INFECTIONS | BRANDEIS UNIVERSITY (US) | 2014-02-20 | — | — | WO | disclosed |