Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | GABRA4 | P48169 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20197212 | 0.86 | KDM4E (0.53) | KDM4ECYP3A4LMNATSHRL3MBTL1 | |
| SCHEMBL1328611 | 0.81 | LNPEP (0.48) | KCNH2KDM4ECYP3A4LMNATSHR | |
| SCHEMBL29058198 | 0.79 | KCNH2 (0.50) | KCNH2KDM4ECYP3A4LMNATDP1 | |
| SCHEMBL921653 | 0.79 | KDM4E (0.47) | KCNH2KDM4ECYP3A4LMNATSHR | |
| SCHEMBL29473921 | 0.79 | KDM4E (0.47) | KCNH2KDM4ECYP3A4LMNATSHR | |
| SCHEMBL31280277 | 0.79 | NOS3 (0.50) | KCNH2KDM4ECYP3A4LMNATSHR | |
| SCHEMBL2553622 | 0.79 | CYP3A4 (0.46) | KCNH2KDM4ECYP3A4LMNATSHR | |
| SCHEMBL1030077 | 0.79 | KDM4E (0.47) | KCNH2KDM4ECYP3A4LMNATSHR | |
| SCHEMBL2550616 | 0.79 | NOS3 (0.50) | KCNH2KDM4ECYP3A4LMNATSHR | |
| SCHEMBL28244414 | 0.79 | KCNH2 (0.50) | KCNH2KDM4ECYP3A4LMNATDP1 |
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-3038622-B1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE | MEDIVATION TECH LLC (US) | 2018-05-30 | — | — | EP | disclosed |