Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 4/20 | 0.38 |
| ▸ | ACHE | P22303 | 4/20 | 0.38 |
| ▸ | PYGL | P06737 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18181047 | 1.00 | KDM1A (0.43) | KDM1AMAOAMAPTNPC1RAB9A | |
| SCHEMBL19999815 | 0.90 | KDM1A (0.44) | KDM1AMAOAMAPTNPC1RAB9A | |
| SCHEMBL18181364 | 0.89 | KDM1A (0.46) | KDM1AMAOABCHEACHEPYGL | |
| SCHEMBL19999794 | 0.86 | KDM1A (0.43) | KDM1AMAOAMAPTS1PR1BCHE | |
| SCHEMBL18181355 | 0.85 | KDM1A (0.42) | KDM1AMAOAMAPTBCHEACHE | |
| SCHEMBL18181100 | 0.85 | KDM1A (0.42) | KDM1AMAOAMAPTBCHEACHE | |
| SCHEMBL19999814 | 0.85 | CTSS (0.44) | KDM1AMAOACTSLCTSBCTSS | |
| SCHEMBL19999799 | 0.84 | KDM1A (0.40) | KDM1AMAOABCHEACHEPYGL | |
| SCHEMBL18181374 | 0.84 | ACHE (0.41) | KDM1AMAOANPC1S1PR1BCHE | |
| SCHEMBL21992329 | 0.84 | ACHE (0.41) | KDM1AMAOANPC1S1PR1BCHE |
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-3286166-B1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | VIIV HEALTHCARE UK NO 5 LTD (GB) | 2020-05-13 | — | — | EP | disclosed |