Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 2/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 3/20 | 0.39 |
| ▸ | PDGFRA | P16234 | 3/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.36 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1002550 | 0.82 | HTT (0.46) | HTTCYP1A2CYP2C19BACE1PDGFRB | |
| SCHEMBL3367827 | 0.79 | EGFR (0.49) | HTTPDGFRBPDGFRAPARP1KDM4E | |
| SCHEMBL13544033 | 0.79 | ALDH1A1 (0.46) | CYP1A2BACE1PDGFRBPDGFRAPARP1 | |
| SCHEMBL19021552 | 0.76 | CYP1A2 (0.39) | CYP1A2PDGFRBPDGFRAPARP1KDM4E | |
| SCHEMBL486937 | 0.76 | PDGFRB (0.65) | CYP1A2PDGFRBPDGFRAPARP1BIRC5 | |
| SCHEMBL31441068 | 0.76 | PDGFRB (0.65) | CYP1A2PDGFRBPDGFRAPARP1BIRC5 | |
| SCHEMBL10077016 | 0.73 | PDGFRB (0.40) | PDGFRBPDGFRAPARP1KDM4EDYRK1A | |
| SCHEMBL3322880 | 0.72 | CYP2A6 (0.50) | BACE1KDM4EALDH1A1RAB9AMEN1 | |
| SCHEMBL29250224 | 0.72 | PARP1 (0.56) | HTTPDGFRBPDGFRAPARP1KDM4E | |
| SCHEMBL12492138 | 0.72 | CYP1A2 (0.43) | HTTCYP1A2CYP2C19BACE1BIRC5 |
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-2010017079-A1 | OXAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH | MERCK & CO., INC. (US) | 2010-02-11 | — | — | WO | disclosed |