Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1027116 | 1.00 | MAOB (0.47) | MAOBMAOARAB9ACYP2D6CYP2C9 | |
| SCHEMBL1026158 | 0.86 | CYP1A2 (0.46) | RAB9ACYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL1026157 | 0.86 | CYP1A2 (0.46) | RAB9ACYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL2453170 | 0.85 | TP53 (0.49) | RAB9AALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL2453168 | 0.85 | TP53 (0.49) | RAB9AALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL1025248 | 0.84 | CYP1A2 (0.50) | MAOBMAOARAB9ACYP2D6CYP2C9 | |
| SCHEMBL1025247 | 0.84 | CYP1A2 (0.50) | MAOBMAOARAB9ACYP2D6CYP2C9 | |
| SCHEMBL1023439 | 0.82 | CYP2D6 (0.43) | RAB9ACYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL1023436 | 0.82 | CYP2D6 (0.43) | RAB9ACYP2D6CYP2C9CYP2C19CYP1A2 | |
| Trifluoroacetic Acid SCHEMBL1028315 | 0.81 | OPRM1 (0.49) | CYP2D6CYP2C9CYP2C19CYP1A2ALDH1A1 |
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-2274288-A2 | MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | Incyte Corporation (US) | 2011-01-19 | — | — | EP | disclosed |