Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.37 |
| ▸ | BRS3 | P32247 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | ACACA | Q13085 | 1/20 | 0.32 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24752319 | 1.00 | METAP1 (0.38) | METAP1ATRBRS3BRAFNPSR1 | |
| SCHEMBL3198182 | 0.80 | ATR (0.41) | METAP1ATRBRD9CYP17A1 | |
| SCHEMBL3588883 | 0.72 | KCNH2 (0.43) | KDM4D | |
| SCHEMBL29127965 | 0.69 | RORC (0.41) | METAP1ATRBRS3BRAFACACB | |
| SCHEMBL34466677 | 0.66 | ATR (0.38) | METAP1ATRBRS3CYP17A1CHRM1 | |
| SCHEMBL31570618 | 0.65 | GAA (0.40) | METAP1ATRBRS3BRAFCYP17A1 | |
| SCHEMBL31570445 | 0.65 | ATR (0.42) | METAP1ATRBRS3BRAFACACB | |
| SCHEMBL30888170 | 0.65 | ATR (0.59) | METAP1ATRCYP17A1 | |
| SCHEMBL16992920 | 0.65 | ATR (0.46) | METAP1ATRBRD9CYP17A1 | |
| SCHEMBL7949833 | 0.65 | MRGPRX1 (0.46) | BRD9 |
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-117881681-A | Substituted pyrrolo [2,3-d ] pyrimidines, their preparation and their therapeutic use | 赛诺菲 | 2024-04-12 | — | — | CN | disclosed |