Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MC4R | P32245 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | MC3R | P41968 | 1/20 | 0.35 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28540095 | 0.78 | NISCH (0.45) | KDM4ENAPRTHCAR2ADORA3TSHR | |
| SCHEMBL17878184 | 0.74 | KDM4E (0.48) | KDM4ECYP1A2ALDH1A1HSP90AA1NPC1 | |
| SCHEMBL28949029 | 0.74 | CYP2A6 (0.41) | KDM4EADRA1APIM2NPC1RAB9A | |
| SCHEMBL30567475 | 0.74 | TRIM24 (0.46) | KDM4ENISCHPIM2HSP90AA1NPC1 | |
| SCHEMBL11614649 | 0.72 | NISCH (0.38) | NISCHCYP1A2HSP90AA1ADORA2AADORA1 | |
| SCHEMBL29009583 | 0.71 | NISCH (0.43) | KDM4ENAPRTHCAR2NISCHCYP1A2 | |
| SCHEMBL31589937 | 0.71 | KDM4E (0.48) | KDM4ENAPRTHCAR2ADORA3TSHR | |
| SCHEMBL29454745 | 0.69 | NISCH (0.50) | KDM4ENAPRTHCAR2ADORA3TSHR | |
| SCHEMBL78566 | 0.69 | NISCH (0.50) | KDM4ENAPRTHCAR2ADORA3TSHR | |
| SCHEMBL29598957 | 0.69 | NISCH (0.50) | KDM4ENAPRTHCAR2ADORA3TSHR |
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-118072952-A | Recurrent abortion patient abortion risk prediction model and construction method thereof | 上海交通大学医学院附属仁济医院 | 2024-05-24 | — | — | CN | disclosed |