Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FLT3 | P36888 | 3/20 | 0.49 |
| ▸ | KDR | P35968 | 3/20 | 0.45 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 2/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | BCR | P11274 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | ATR | Q13535 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | TYK2 | P29597 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 1/20 | 0.40 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25591605 | 0.89 | LRRK2 (0.47) | FLT3KDRLRRK2GSK3BMAPT | |
| SCHEMBL25591688 | 0.88 | KDR (0.45) | FLT3KDRLRRK2MAPTTP53 | |
| SCHEMBL25590490 | 0.80 | ATR (0.58) | MAPTATRJAK2KDM4ENPC1 | |
| SCHEMBL25590495 | 0.80 | RAB9A (0.55) | MAPTTP53ATRKDM4ENPC1 | |
| SCHEMBL25590474 | 0.73 | ATR (0.51) | ADORA3ABL1BCRMAPTTP53 | |
| SCHEMBL25593585 | 0.73 | ATR (0.43) | KDRMAPTTHRBATRRAB9A | |
| SCHEMBL25590489 | 0.72 | ATR (0.45) | ADORA3MAPTTP53THRBATR | |
| SCHEMBL25590487 | 0.72 | LRRK2 (0.46) | LRRK2ADORA3MAPTTP53THRB | |
| SCHEMBL25593788 | 0.71 | ATR (0.48) | LRRK2TP53ATRNPC1ALDH1A1 | |
| SCHEMBL30184009 | 0.71 | KDM4E (0.55) | FLT3KDRMAPTATRTYK2 |
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-2023088435-A1 | PREPARATION FOR TRISUBSTITUTED PYRIDINE DERIVATIVE AND APPLICATION AS AROMATIC HYDROCARBON RECEPTOR MODULATOR | 成都奥睿药业有限公司 | 2023-05-25 | — | — | WO | disclosed |