Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.51 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CREBBP | Q92793 | 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 | |
|---|---|---|---|---|
| SCHEMBL1195462 | 1.00 | AKR1C3 (0.51) | AKR1C3AKR1C2ALDH1A1KMT2AMEN1 | |
| SCHEMBL1169066 | 0.82 | AKR1C3 (0.72) | AKR1C3AKR1C2PTGS1PTGS2TAS2R14 | |
| SCHEMBL22628424 | 0.80 | AKR1C3 (0.44) | AKR1C3AKR1C2NPC1RAB9APTGS1 | |
| SCHEMBL477610 | 0.80 | AKR1C3 (0.51) | AKR1C3AKR1C2ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL28967024 | 0.79 | AKR1C3 (0.47) | AKR1C3AKR1C2ALDH1A1KMT2AMEN1 | |
| SCHEMBL20560610 | 0.78 | AKR1C3 (0.50) | AKR1C3AKR1C2KMT2ASMN1; SMN2NPC1 | |
| SCHEMBL279656 | 0.78 | ALDH1A1 (0.59) | ALDH1A1KMT2AMEN1SMN1; SMN2MAPK1 | |
| SCHEMBL1194372 | 0.76 | GSK3B (0.52) | AKR1C3AKR1C2PTGS1PTGS2TAS2R14 | |
| SCHEMBL1633802 | 0.76 | ALDH1A1 (0.58) | AKR1C3AKR1C2ALDH1A1KMT2AMEN1 | |
| SCHEMBL30782680 | 0.76 | ALDH1A1 (0.58) | AKR1C3AKR1C2ALDH1A1KMT2AMEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117534667-A | Crystal forms of pyridopyrimidinone compound, acid salts thereof, crystal forms of acid salts thereof and use | 武汉人福创新药物研发中心有限公司 | 2024-02-09 | — | — | CN | disclosed |
| CN-117357650-A | Pharmaceutical composition comprising SOS1 inhibitor | 武汉人福创新药物研发中心有限公司 | 2024-01-09 | — | — | CN | disclosed |
| CN-114907341-A | Pyridopyrimidinone derivatives, and preparation method and application thereof | 武汉人福创新药物研发中心有限公司 | 2022-08-16 | — | — | CN | disclosed |
| CN-114716478-A | 6-substituted phosphoryl quinazoline derivative and preparation method and application thereof | 武汉人福创新药物研发中心有限公司 | 2022-07-08 | — | — | CN | disclosed |