Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 5/20 | 0.37 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.37 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CTSL | P07711 | 2/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
| ▸ | PTGDR | Q13258 | 2/20 | 0.34 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30516654 | 0.77 | HDAC1 (0.43) | HDAC1HPGDCES2CES1LCK | |
| SCHEMBL12181487 | 0.75 | HDAC1 (0.55) | HDAC1HPGDCES2CES1NPC1 | |
| SCHEMBL12181152 | 0.75 | HDAC1 (0.55) | HDAC1HPGDCES2CES1LCK | |
| SCHEMBL30516670 | 0.75 | NPC1 (0.49) | HPGDDAOCTSSNPC1RAB9A | |
| SCHEMBL15296751 | 0.75 | HDAC1 (0.58) | HDAC1HPGDCES2CES1LCK | |
| SCHEMBL30516660 | 0.74 | TSHR (0.60) | HDAC1HPGDNPC1RAB9A | |
| SCHEMBL15296752 | 0.74 | RAB9A (0.57) | HDAC1HPGDNPC1RAB9AACKR3 | |
| SCHEMBL30516667 | 0.74 | HDAC1 (0.40) | HDAC1HPGDCES2CES1LCK | |
| Hydrochloric Acid SCHEMBL27721996 | 0.73 | HDAC1 (0.56) | HDAC1HPGDCES2CES1LCK | |
| SCHEMBL30516645 | 0.72 | NAMPT (0.39) | HPGDNPC1RAB9APTGDR |
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 |
|---|---|---|---|---|---|---|---|
| CN-116529238-A | Novel prostaglandin E 2 Compounds with receptor inhibiting activity and uses thereof | 治纳辅医药科技有限公司 | 2023-08-01 | — | — | CN | disclosed |