Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 5/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.37 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28092694 | 0.87 | AVPR1A (0.45) | AVPR1AHSD11B1MAPK1NPC1RAB9A | |
| SCHEMBL3094477 | 0.81 | AVPR1A (0.55) | AVPR1AHSD11B1MAPK1NPC1RAB9A | |
| SCHEMBL9226464 | 0.81 | BCHE (0.49) | AVPR1AHSD11B1MAPK1NPC1RAB9A | |
| SCHEMBL30379140 | 0.81 | BCHE (0.49) | AVPR1AHSD11B1MAPK1NPC1RAB9A | |
| SCHEMBL28092454 | 0.77 | HSD11B1 (0.46) | AVPR1AHSD11B1MAPK1NPC1RAB9A | |
| SCHEMBL28092508 | 0.77 | P2RX4 (0.49) | AVPR1AHSD11B1MAPK1NPC1RAB9A | |
| SCHEMBL19949852 | 0.76 | AVPR1A (0.51) | AVPR1AHSD11B1MAPK1THRBGPBAR1 | |
| SCHEMBL29505992 | 0.75 | MAPK1 (0.60) | AVPR1AHSD11B1MAPK1THRBGPBAR1 | |
| SCHEMBL975814 | 0.75 | MAPK1 (0.60) | AVPR1AHSD11B1MAPK1THRBGPBAR1 | |
| SCHEMBL28092562 | 0.73 | AVPR1A (0.49) | AVPR1AHSD11B1MAPK1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-106029076-A | Benzopiperazine compositions as BET bromodomain inhibitors | 福马疗法公司 | 2016-10-12 | — | — | CN | claimed |
| CN-106029076-A | Benzopiperazine compositions as BET bromodomain inhibitors | 福马疗法公司 | 2016-10-12 | — | — | CN | disclosed |