Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | AGER | Q15109 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | WNT3A | P56704 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL696920 | 0.80 | KMT2A (0.51) | KMT2ANPC1RAB9AF2RL1HTT | |
| SCHEMBL653632 | 0.79 | KMT2A (0.67) | KMT2ANPC1RAB9AF2RL1HTT | |
| SCHEMBL722012 | 0.76 | KMT2A (0.59) | KMT2ANPC1RAB9AF2RL1HTT | |
| SCHEMBL1324 | 0.74 | NPC1 (0.62) | KMT2ANPC1RAB9AF2RL1HTT | |
| SCHEMBL2574266 | 0.74 | KMT2A (0.60) | KMT2ANPC1RAB9AF2RL1ALDH1A1 | |
| SCHEMBL698128 | 0.74 | KMT2A (0.56) | KMT2ANPC1RAB9AF2RL1HTT | |
| SCHEMBL1691052 | 0.73 | KMT2A (0.44) | KMT2ANPC1RAB9AF2RL1HTT | |
| SCHEMBL20385460 | 0.73 | KMT2A (0.52) | KMT2ANPC1RAB9AHTTMAPT | |
| Bromide SCHEMBL7371333 | 0.72 | NPC1 (0.60) | KMT2ANPC1RAB9AF2RL1HTT | |
| Ammonia Solution, Strong SCHEMBL16266978 | 0.72 | NPC1 (0.60) | KMT2ANPC1RAB9AF2RL1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-7799808-B2 | α-Haloketone derivatives of imidazolyl-substituted aromatic compounds and compounds prepared therefrom | NEUROGENETIC PHARMACEUTICALS, INC. (US) | 2010-09-21 | — | — | US | claimed |