Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPL | P05186 | 1/20 | 0.51 |
| ▸ | ALPG | P10696 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL19908743 | 0.78 | ALDH1A1 (0.40) | ALPLALPGMAOBALDH1A1GLA | |
| SCHEMBL19908770 | 0.77 | ALDH1A1 (0.41) | ALPLALPGMAOBALDH1A1GLA | |
| SCHEMBL29790265 | 0.75 | KDM4E (0.41) | ALDH1A1HTTKDM4EHPGDMAPT | |
| SCHEMBL23469141 | 0.74 | MAPT (0.39) | ALDH1A1KDM4EHPGDRECQLMAPT | |
| SCHEMBL19908562 | 0.71 | ALDH1A1 (0.53) | ALPLALPGMAOBALDH1A1GLA | |
| SCHEMBL11752997 | 0.69 | ALPL (0.60) | ALPLALPGMAOBALDH1A1GLA | |
| SCHEMBL19908620 | 0.68 | ALPL (0.63) | ALPLALPGMAOBALDH1A1GLA | |
| SCHEMBL11551316 | 0.67 | ALPL (0.61) | ALPLALPGMAOBALDH1A1GLA | |
| SCHEMBL11680119 | 0.67 | ALPL (0.61) | ALPLALPGMAOBALDH1A1GLA | |
| SCHEMBL11678584 | 0.67 | KDM4E (0.62) | ALPLALPGMAOBALDH1A1GLA |
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-3287441-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2018-02-28 | — | — | EP | disclosed |