Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SCN7A | Q01118 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 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 | |
|---|---|---|---|---|
| SCHEMBL18326368 | 0.86 | HTT (0.48) | MAPK1SYKKCNH2LMNACNR1 | |
| SCHEMBL20373438 | 0.80 | LMNA (0.41) | MAPK1LMNACNR1CNR2BRD4 | |
| SCHEMBL16905795 | 0.78 | CREBBP (0.51) | BRD4CREBBP | |
| SCHEMBL20373739 | 0.74 | SCN7A (0.41) | KCNH2KDM4EALDH1A1HPGDSCN7A | |
| SCHEMBL29924199 | 0.70 | SCN7A (0.48) | CYP2D6TSHRLMNACNR1BRD4 | |
| SCHEMBL28901289 | 0.70 | SCN7A (0.48) | CYP2D6TSHRLMNACNR1BRD4 | |
| SCHEMBL12060299 | 0.70 | KCNH2 (0.62) | KCNH2 | |
| SCHEMBL669552 | 0.69 | NPSR1 (0.48) | TSHRLMNACNR1CNR2ALDH1A1 | |
| SCHEMBL20357593 | 0.67 | CREBBP (0.51) | CYP2D6LMNABRD4CREBBPALDH1A1 | |
| SCHEMBL706949 | 0.66 | KCNH2 (0.56) | CYP2D6KCNH2 |
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-3092227-B1 | BICYCLIC HETEROCYCLIC DERIVATIVES AS BROMODOMAIN INHIBITORS | ORION CORP (FI) | 2018-07-11 | — | — | EP | disclosed |