Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | VDR | P11473 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | AGO2 | Q9UKV8 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13125431 | 0.84 | HSP90AA1 (0.57) | P2RY12CYP2C19KDM4EALDH1A1LMNA | |
| SCHEMBL11913674 | 0.79 | P2RY12 (0.49) | P2RY12CYP2C19ALDH1A1LMNAKEAP1 | |
| SCHEMBL3064020 | 0.77 | CYP2C19 (0.48) | P2RY12CYP2C19ALDH1A1LMNAKEAP1 | |
| SCHEMBL3386026 | 0.75 | KEAP1 (0.51) | P2RY12CYP2C19KDM4EALDH1A1LMNA | |
| SCHEMBL9621580 | 0.75 | P2RY12 (0.64) | P2RY12CYP2C19KDM4EALDH1A1KEAP1 | |
| SCHEMBL9224058 | 0.73 | KEAP1 (0.49) | P2RY12CYP2C19KDM4EALDH1A1LMNA | |
| SCHEMBL31033502 | 0.73 | CYP2C19 (0.47) | P2RY12CYP2C19KDM4EALDH1A1LMNA | |
| SCHEMBL9804556 | 0.72 | CYP2C19 (0.52) | P2RY12CYP2C19KDM4EALDH1A1LMNA | |
| SCHEMBL5083041 | 0.71 | MEN1 (0.58) | ALDH1A1LMNAKEAP1NFE2L2MEN1 | |
| SCHEMBL10656714 | 0.71 | CYP2C19 (0.45) | P2RY12CYP2C19ALDH1A1LMNAKEAP1 |
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-2012079583-A1 | SYSTEM PROVIDING CONTROLLED DELIVERY OF GASEOUS CO FOR CARBONYLATION REACTIONS | AARHUS UNIVERSITET (DK) | 2012-06-21 | — | — | WO | disclosed |