Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | MAT2A | P31153 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL5563104 | 0.82 | PDE4D (0.46) | KMT2AADORA3PDE4BPDE4DMAPT | |
| SCHEMBL4502696 | 0.73 | L3MBTL1 (0.49) | KMT2AMAPTALDH1A1KDM4E | |
| SCHEMBL28478958 | 0.71 | TRPM8 (0.58) | KMT2ATRPM8ADORA3HPGDMAPT | |
| SCHEMBL10375304 | 0.70 | KDM4E (0.61) | KMT2ATRPM8ADORA3HPGDMAPT | |
| SCHEMBL8166287 | 0.69 | KDM4E (0.43) | KMT2AMAPTALDH1A1PLA2G2ACTSA | |
| SCHEMBL4515441 | 0.69 | ADORA3 (0.53) | TRPM8ADORA3HPGDMAPTALDH1A1 | |
| SCHEMBL1330555 | 0.69 | ALDH1A1 (0.44) | KMT2ACA12CA1CA2CA7 | |
| SCHEMBL10754019 | 0.68 | POLB (0.44) | KMT2APDE4BPDE4DMAPTALDH1A1 | |
| SCHEMBL10914093 | 0.67 | ALDH1A1 (0.46) | KMT2APDE4BPDE4DMAPTALDH1A1 | |
| SCHEMBL11010179 | 0.67 | SMN1; SMN2 (0.66) | KMT2AADORA3CA12CA1CA2 |
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-2005009392-A2 | DIHYDROPYRIMIDONE INHIBITORS OF CALCIUM CHANNEL FUNCTION | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-02-03 | — | — | WO | disclosed |