Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2490669 | 0.85 | SMN1; SMN2 (0.54) | NPC1GAAMAPTKDM4EALDH1A1 | |
| SCHEMBL18906043 | 0.83 | HDAC1 (0.64) | NPC1RAB9AHDAC1HDAC3HDAC4 | |
| SCHEMBL10744458 | 0.79 | GRM5 (0.63) | NPC1RAB9AHDAC1HDAC3HDAC4 | |
| SCHEMBL31087258 | 0.78 | HDAC3 (0.57) | NPC1RAB9AHDAC1HDAC3HDAC4 | |
| SCHEMBL7989152 | 0.76 | HDAC1 (0.77) | NPC1RAB9AHDAC1HDAC3HDAC4 | |
| SCHEMBL31087264 | 0.76 | HDAC6 (0.62) | NPC1RAB9AHDAC1HDAC3HDAC4 | |
| SCHEMBL28611795 | 0.76 | HDAC6 (0.62) | NPC1RAB9AHDAC1HDAC3HDAC4 | |
| SCHEMBL3381752 | 0.74 | NPC1 (0.59) | NPC1RAB9AHDAC1HDAC3HDAC4 | |
| SCHEMBL5239511 | 0.74 | GRM4 (0.57) | NPC1RAB9AHDAC6MAPTKDM4E | |
| SCHEMBL11526133 | 0.74 | CLCN2 (0.53) | NPC1RAB9AMAPTKDM4EALDH1A1 |
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-2022111222-A1 | AMIDE DERIVATIVE SERVING AS PROSTAGLANDIN EP4 RECEPTOR ANTAGONIST, AND USE THEREOF | 安润医药科技（苏州）有限公司 | 2022-06-02 | — | — | WO | disclosed |