Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.30 |
| ▸ | NOS3 | P29474 | 2/20 | 0.30 |
| ▸ | NOS2 | P35228 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23234668 | 0.80 | HRH4 (0.33) | HRH4NOS3NOS2 | |
| SCHEMBL29663602 | 0.76 | KDM4E (0.37) | IKBKBALDH1A1 | |
| SCHEMBL17619234 | 0.76 | KDM4E (0.37) | IKBKBALDH1A1 | |
| SCHEMBL21608277 | 0.73 | NOS2 (0.52) | KMT2AHRH4NOS3NOS2 | |
| SCHEMBL23137481 | 0.72 | PRKCI (0.35) | IKBKBHRH4NOS3NOS2 | |
| SCHEMBL15758316 | 0.72 | NUDT1 (0.51) | NUDT1NPC1RAB9AKMT2ABRD4 | |
| SCHEMBL31522898 | 0.71 | BRD4 (0.32) | NPC1RAB9ABRD4ALDH1A1HSD17B10 | |
| SCHEMBL8296523 | 0.70 | NAPRT (0.47) | NPC1RAB9AALDH1A1HSD17B10TP53 | |
| SCHEMBL20509939 | 0.70 | KDR (0.37) | NUDT1NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL21542765 | 0.70 | NOS3 (0.38) | KMT2AHRH4NOS3NOS2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116171155-B | Pyrido [2,3-d ] pyrimidine-2 (1H) -ketone derivative, preparation method and application thereof | 上海和誉生物医药科技有限公司 | 2024-09-17 | — | — | CN | disclosed |
| CN-116171155-A | Pyrido [2,3-d ] pyrimidine-2 (1H) -ketone derivative, preparation method and application thereof | 上海和誉生物医药科技有限公司 | 2023-05-26 | — | — | CN | disclosed |
| WO-2022121839-A1 | PYRIDO[2,3-D]PYRIMIDIN-2(1H)-ONE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 上海和誉生物医药科技有限公司 | 2022-06-16 | — | — | WO | disclosed |