Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | TGM2 | P21980 | 6/20 | 0.48 |
| ▸ | MAOB | P27338 | 8/20 | 0.43 |
| ▸ | MAOA | P21397 | 7/20 | 0.43 |
| ▸ | CES1 | P23141 | 4/20 | 0.43 |
| ▸ | TLK2 | Q86UE8 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17138201 | 0.76 | PRSS1 (0.43) | ALDH1A1GAAXBP1ATMNPSR1 | |
| SCHEMBL27869739 | 0.74 | ALDH1A1 (0.66) | ALDH1A1TGM2MAOBMAOACES1 | |
| SCHEMBL28129972 | 0.74 | GAA (0.50) | GAAXBP1ATMNPSR1L3MBTL1 | |
| SCHEMBL9114249 | 0.74 | TGM2 (0.45) | ALDH1A1TGM2MAOBMAOACES1 | |
| SCHEMBL22471847 | 0.74 | GAA (0.50) | GAAXBP1ATMNPSR1L3MBTL1 | |
| SCHEMBL28133278 | 0.73 | LMNA (0.47) | GAAXBP1ATMNPSR1L3MBTL1 | |
| SCHEMBL4627666 | 0.72 | TGM2 (0.67) | ALDH1A1TGM2MAOBMAOACES1 | |
| SCHEMBL15546907 | 0.72 | ELANE (0.46) | — | |
| SCHEMBL20222952 | 0.72 | LMNA (0.49) | ALDH1A1MAOAGAAXBP1ATM | |
| SCHEMBL6913900 | 0.72 | NR5A1 (0.50) | ALDH1A1GAAXBP1ATMNPSR1 |
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-102648178-A | Quinazoline derivatives | MERCK PATENT GMBH | 2012-08-22 | — | — | CN | disclosed |