Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CTRC | Q99895 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 2/20 | 0.36 |
| ▸ | NR4A2 | P43354 | 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 | |
|---|---|---|---|---|
| SCHEMBL12887782 | 0.85 | ADORA3 (0.42) | ADORA3MEN1KMT2AHPGDMAPT | |
| SCHEMBL12885445 | 0.76 | KMO (0.40) | ADORA3MEN1KMT2AMAPTRXRA | |
| SCHEMBL9550200 | 0.75 | CNR1 (0.54) | MAPTCTRCRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL12888371 | 0.71 | ADORA3 (0.41) | ADORA3MEN1KMT2AALDH1A1KDM4E | |
| SCHEMBL16927980 | 0.68 | PIK3CA (0.39) | ADORA3MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL21001267 | 0.66 | MCL1 (0.61) | ADORA3MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL28817004 | 0.66 | NPC1 (0.58) | ADORA3MEN1KMT2AALDH1A1HPGD | |
| SCHEMBL29500282 | 0.66 | MEN1 (0.83) | MEN1KMT2AALDH1A1HPGDMAPT | |
| SCHEMBL23674305 | 0.65 | LTB4R (0.48) | ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL11619536 | 0.65 | MEN1 (0.55) | ADORA3MEN1KMT2AALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009125870-A1 | PYRIMIDINE, PYRIDINE AND TRIAZINE DERIVATIVES AS MAXI-K CHANNEL OPENERS. | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2009-10-15 | — | — | WO | disclosed |