Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | NAMPT | P43490 | 6/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.37 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17090366 | 0.90 | MAPK14 (0.45) | ALDH1A1RAB9ANAMPTCRHR1MAPK14 | |
| SCHEMBL17090363 | 0.88 | HTT (0.44) | ALDH1A1RAB9AHTTNAMPTIKBKB | |
| SCHEMBL13564822 | 0.84 | MEN1 (0.43) | ALDH1A1RAB9ACRHR1KMT2AHPGD | |
| SCHEMBL17090170 | 0.84 | KDM1A (0.39) | HTTCRHR1MAPK14 | |
| SCHEMBL10114986 | 0.83 | HTT (0.55) | ALDH1A1RAB9AHTTNAMPTKMT2A | |
| SCHEMBL17090417 | 0.83 | LMNA (0.53) | ALDH1A1RAB9ACRHR1MAPK14KMT2A | |
| SCHEMBL13204427 | 0.83 | HTT (0.55) | ALDH1A1RAB9AHTTNAMPTKMT2A | |
| SCHEMBL13564877 | 0.82 | CRHR1 (0.47) | ALDH1A1RAB9AHTTCRHR1MAPK14 | |
| SCHEMBL13439231 | 0.82 | HPGD (0.38) | ALDH1A1CRHR1HPGD | |
| SCHEMBL13462871 | 0.82 | HPGD (0.38) | ALDH1A1CRHR1HPGD |
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-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |