Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.36 |
| ▸ | HTR3B | O95264 | 2/20 | 0.36 |
| ▸ | HTR3A | P46098 | 2/20 | 0.36 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.36 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13660242 | 1.00 | KMT2A (0.45) | KMT2ABACE1ADORA3MAPK1HTT | |
| SCHEMBL26597940 | 0.79 | KMT2A (0.45) | KMT2ABACE1ADORA3MAPK1HTT | |
| SCHEMBL540850 | 0.79 | MAPK1 (0.59) | KMT2ABACE1ADORA3MAPK1HTT | |
| SCHEMBL9385552 | 0.79 | IDO1 (0.50) | MAPK1KDM4EALDH1A1TSHRCYP2C19 | |
| SCHEMBL14947869 | 0.78 | KMT2A (0.59) | KMT2ABACE1ADORA3MAPK1HTT | |
| SCHEMBL10247452 | 0.78 | KMT2A (0.64) | KMT2ABACE1ADORA3MAPK1HTT | |
| SCHEMBL15746018 | 0.76 | BACE1 (0.42) | KMT2ABACE1ADORA3MAPK1HTT | |
| SCHEMBL13506477 | 0.76 | KMT2A (0.42) | KMT2ABACE1ADORA3MAPK1HTT | |
| SCHEMBL13052994 | 0.76 | KMT2A (0.49) | KMT2ABACE1ADORA3MAPK1HTT | |
| SCHEMBL889831 | 0.74 | MAPK1 (0.61) | KMT2AMAPK1HTTKDM4EATM |
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-2018023851-A1 | IMIDAZOPYRIDINE THIOGLYCOLIC ACID DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 山东大学 | 2018-02-08 | — | — | WO | disclosed |