Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | CDC7 | O00311 | 1/20 | 0.46 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | SLC26A6 | Q9BXS9 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8144214 | 0.95 | NPSR1 (0.58) | NPSR1CYP1A2CYP3A4GAACYP2C9 | |
| SCHEMBL8128482 | 0.84 | ALDH1A1 (0.46) | NPSR1CYP1A2CYP3A4GAACYP2C9 | |
| SCHEMBL8137173 | 0.81 | NPSR1 (0.40) | NPSR1CYP1A2CYP3A4GAACYP2C9 | |
| SCHEMBL2840279 | 0.80 | NPSR1 (0.73) | NPSR1CYP1A2CYP3A4GAACYP2C9 | |
| SCHEMBL8139117 | 0.78 | CDC7 (0.43) | NPSR1CYP1A2CYP2C9MEN1KMT2A | |
| SCHEMBL8127687 | 0.78 | LMNA (0.41) | NPSR1CYP1A2CYP3A4GAACYP2C9 | |
| SCHEMBL8143187 | 0.77 | MAPK8 (0.42) | NPSR1CYP1A2CYP3A4GAACYP2C9 | |
| SCHEMBL13510962 | 0.76 | NPSR1 (0.67) | NPSR1CYP1A2CYP3A4GAACYP2C9 | |
| SCHEMBL8144240 | 0.75 | NPC1 (0.37) | NPSR1CYP1A2CYP2C9MEN1KMT2A | |
| SCHEMBL24261170 | 0.75 | ADORA2A (0.68) | NPSR1MEN1KMT2ARAB9AADORA2A |
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-1996022992-A1 | TRICYCLIC SUBSTITUTED HEXAHYDROBENZ[E]ISOINDOLE ALPHA-1 ADRENERGIC ANTAGONISTS | ABBOTT LABORATORIES (US) | 1996-08-01 | — | — | WO | disclosed |