Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | FLT1 | P17948 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GALR3 | O60755 | 1/20 | 0.38 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19575679 | 0.91 | TDP1 (0.47) | CDK1TDP1SMN1; SMN2CCNE2CCNE1 | |
| SCHEMBL26212264 | 0.87 | YTHDC1 (0.48) | TDP1SMN1; SMN2POLBYTHDC1 | |
| SCHEMBL19575766 | 0.85 | FLT1 (0.44) | TDP1SMN1; SMN2FLT1KDRRAB9A | |
| SCHEMBL26224084 | 0.84 | SMN1; SMN2 (0.47) | TDP1SMN1; SMN2FLT1KDRRAB9A | |
| SCHEMBL19555217 | 0.84 | TDP1 (0.49) | TDP1SMN1; SMN2ADORA3ADORA2AADORA2B | |
| SCHEMBL19575520 | 0.83 | TDP1 (0.43) | TDP1SMN1; SMN2FLT1KDRRAB9A | |
| SCHEMBL26224186 | 0.83 | YTHDC1 (0.48) | YTHDC1 | |
| SCHEMBL19575521 | 0.82 | TDP1 (0.41) | TDP1SMN1; SMN2ADORA3ADORA2AADORA2B | |
| SCHEMBL19575606 | 0.82 | PTPN7 (0.42) | TDP1SMN1; SMN2ADORA3ADORA2AADORA2B | |
| SCHEMBL26212787 | 0.82 | L3MBTL1 (0.43) | TDP1SMN1; SMN2FLT1KDRRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3452477-B1 | ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS | B C I PHARMA (BE) | 2023-09-13 | — | — | EP | disclosed |