Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.41 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.41 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.41 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.41 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.41 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.41 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 8/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GRK2 | P25098 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | JAK1 | P23458 | 2/20 | 0.36 |
| ▸ | TYK2 | P29597 | 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 | |
|---|---|---|---|---|
| SCHEMBL1759083 | 0.85 | TTR (0.46) | NOS1MAOBALDH1A1IDO1METAP2 | |
| SCHEMBL13132270 | 0.83 | TDO2 (0.50) | NOS1MAOBKDM4EALDH1A1MAPT | |
| SCHEMBL12664045 | 0.83 | NOS1 (0.40) | NOS1MAOBGRK2IDO1METAP2 | |
| SCHEMBL12647460 | 0.83 | NOS1 (0.40) | NOS1MAOBGRK2IDO1JAK2 | |
| SCHEMBL4410091 | 0.78 | LMNA (0.50) | MAOBKDM4EALDH1A1MAPTMETAP2 | |
| SCHEMBL18508895 | 0.73 | NOS1 (0.37) | NOS1MAOBGRK2IDO1METAP2 | |
| SCHEMBL14487466 | 0.72 | METAP2 (0.56) | NOS1IDO1METAP2 | |
| SCHEMBL16618130 | 0.69 | IDO1 (0.61) | NOS1IDO1METAP2 | |
| SCHEMBL7572191 | 0.69 | NOS1 (0.50) | NOS1KDM4EALDH1A1MAPTIDO1 | |
| SCHEMBL31190826 | 0.69 | METAP2 (0.53) | NOS1IDO1METAP2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2947082-A1 | N1-PYRAZOLOSPIROKETONE ACETYL-CoA CARBOXYLASE INHIBITORS | Pfizer Inc (US) | 2015-11-25 | — | — | EP | disclosed |