Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.45 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP3 | P08254 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3319710 | 0.91 | RAB9A (0.49) | HDAC1HDAC6GRM2NPC1RAB9A | |
| SCHEMBL5732991 | 0.91 | RAB9A (0.49) | HDAC1HDAC6GRM2NPC1RAB9A | |
| SCHEMBL5731641 | 0.84 | HTT (0.52) | HDAC1HDAC6NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5807714 | 0.77 | SMN1; SMN2 (0.44) | HDAC1HDAC6NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6006832 | 0.75 | AGTR1 (0.52) | — | |
| SCHEMBL5732287 | 0.72 | HTT (0.50) | HDAC1HDAC6NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL3318705 | 0.72 | HTT (0.50) | HDAC1HDAC6NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8095728 | 0.70 | TSHR (0.49) | HDAC1HDAC6TSHR | |
| SCHEMBL31271991 | 0.70 | MAPT (0.40) | NPC1RAB9ASMN1; SMN2ALDH1A1P2RX7 | |
| SCHEMBL3318983 | 0.69 | HTT (0.39) | HDAC1HDAC6GRM2RAB9AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018216822-A1 | NOVEL IMIDAZOLE DERIVATIVES | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2018-11-29 | — | — | WO | disclosed |