Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28554628 | 0.86 | ATM (0.68) | ATMMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL28555092 | 0.82 | ATM (0.63) | ATMMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL5696416 | 0.76 | ATM (0.61) | ATMMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL20552691 | 0.73 | ATM (0.51) | ATMMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL20552426 | 0.71 | ATM (0.49) | ATMMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL20552451 | 0.70 | ATM (0.48) | ATMMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL20551695 | 0.69 | MAPT (0.50) | ATMMEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL25786347 | 0.67 | L3MBTL1 (0.49) | ATMMEN1KMT2AALDH1A1POLB | |
| SCHEMBL20552528 | 0.66 | ATM (0.44) | ATMMEN1KMT2AALDH1A1POLB | |
| SCHEMBL20551819 | 0.66 | ATM (0.44) | ATMMEN1KMT2AALDH1A1SMN1; SMN2 |
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-112724141-A | GPR109A protein receptor inhibitor and preparation and application thereof | 南京艾美斐生物医药科技有限公司 | 2021-04-30 | — | — | CN | disclosed |