Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.55 |
| ▸ | EPRS1 | P07814 | 2/20 | 0.53 |
| ▸ | ACHE | P22303 | 2/20 | 0.51 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.40 |
| ▸ | NCF1 | P14598 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL436729 | 0.80 | ACHE (0.60) | ADORA1ADORA2AACHEMEN1KMT2A | |
| SCHEMBL439581 | 0.79 | ACHE (0.51) | ADORA1ADORA2AACHEMEN1KMT2A | |
| SCHEMBL438193 | 0.78 | NR4A2 (0.51) | ADORA1ADORA2AEPRS1MEN1KMT2A | |
| SCHEMBL437510 | 0.77 | RXFP1 (0.52) | ADORA1ADORA2AACHEMEN1KMT2A | |
| SCHEMBL440069 | 0.73 | NOS2 (0.41) | EPRS1ALDH1A1 | |
| SCHEMBL440237 | 0.73 | ACHE (0.59) | ADORA1ADORA2AACHEMEN1KMT2A | |
| SCHEMBL438920 | 0.71 | ACHE (0.70) | ADORA1ADORA2AEPRS1ACHEMEN1 | |
| SCHEMBL27469565 | 0.71 | ACHE (0.70) | ADORA1ADORA2AACHEMEN1KMT2A | |
| SCHEMBL22136019 | 0.71 | ACHE (0.51) | ADORA1ADORA2AACHEALDH1A1KDM4E | |
| SCHEMBL117482 | 0.70 | EPRS1 (1.00) | EPRS1PPARA |
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-20120065166-A1 | Bone Modulators And Methods Therewith | ESPINA VIRGINIA (US) | 2012-03-15 | — | — | US | disclosed |