Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | DRD4 | P21917 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CPT1A | P50416 | 2/20 | 0.32 |
| ▸ | CPT1B | Q92523 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16896788 | 0.76 | HTT (0.43) | TSHRDRD4POLBMEN1KMT2A | |
| SCHEMBL20373572 | 0.75 | P2RX7 (0.40) | KDM4EALDH1A1MAPTTP53PKM | |
| SCHEMBL16896911 | 0.74 | DRD4 (0.40) | TSHRDRD4MEN1KMT2AHDAC1 | |
| SCHEMBL16896736 | 0.70 | DRD4 (0.42) | KDM4EALDH1A1MAPTPKMDRD4 | |
| SCHEMBL18326385 | 0.66 | EZH2 (0.43) | — | |
| SCHEMBL27435059 | 0.64 | AR (0.47) | DRD4POLBAR | |
| SCHEMBL18401134 | 0.62 | TSHR (0.44) | KDM4EMAPTPKMTSHRDRD4 | |
| SCHEMBL14641711 | 0.61 | TSHR (0.38) | ALDH1A1MAPTTSHRDRD4AR | |
| SCHEMBL12107796 | 0.61 | HTR2C (0.43) | TSHRDRD4ARHDAC1HDAC6 | |
| SCHEMBL3789909 | 0.61 | SMN1; SMN2 (0.45) | KDM4EMAPTTP53PKMSMN1; SMN2 |
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 |