Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MITF | O75030 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CETP | P11597 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 3/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23628464 | 0.79 | KDM4E (0.40) | KDM4EMITFALDH1A1HPGDKLF5 | |
| SCHEMBL23628496 | 0.76 | L3MBTL1 (0.43) | KDM4EMITFALDH1A1HPGDKLF5 | |
| SCHEMBL23628489 | 0.75 | RAB9A (0.43) | KDM4EMITFALDH1A1HPGDKLF5 | |
| SCHEMBL23628493 | 0.73 | KDM4E (0.46) | KDM4EMITFALDH1A1HPGDKLF5 | |
| SCHEMBL23628497 | 0.71 | L3MBTL1 (0.44) | KDM4EALDH1A1HTTLMNAMAPT | |
| SCHEMBL18383188 | 0.69 | ALDH1A1 (0.43) | KDM4EMITFALDH1A1HPGDKLF5 | |
| SCHEMBL558665 | 0.69 | KDR (0.47) | KDM4EMITFALDH1A1HPGDKLF5 | |
| SCHEMBL18260522 | 0.69 | KDM4E (0.39) | KDM4EMITFALDH1A1HPGDKLF5 | |
| SCHEMBL29565434 | 0.69 | KDM4E (0.39) | KDM4EMITFALDH1A1HPGDKLF5 | |
| SCHEMBL9416777 | 0.68 | ALDH1A1 (0.51) | KDM4EALDH1A1SMN1; SMN2MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3353176-B1 | BICYCLIC COMPOUNDS AS ATX INHIBITORS | HOFFMANN LA ROCHE (CH) | 2022-01-19 | — | — | EP | claimed |
| EP-3353178-B1 | BICYCLIC COMPOUNDS AS DUAL ATX/CA INHIBITORS | HOFFMANN LA ROCHE (CH) | 2021-07-14 | — | — | EP | claimed |