Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.68 |
| ▸ | PLCD1 | P51178 | 1/20 | 0.62 |
| ▸ | CNR1 | P21554 | 3/20 | 0.60 |
| ▸ | CA12 | O43570 | 2/20 | 0.58 |
| ▸ | CA1 | P00915 | 2/20 | 0.58 |
| ▸ | CA2 | P00918 | 2/20 | 0.58 |
| ▸ | CA9 | Q16790 | 2/20 | 0.58 |
| ▸ | F2 | P00734 | 1/20 | 0.57 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.57 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.57 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.57 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.57 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.56 |
| ▸ | CNR2 | P34972 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | ABL1 | P00519 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | IDE | P14735 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL8407567 | 0.90 | TDP1 (0.76) | TDP1PLCD1CA12CA1CA2 | |
| SCHEMBL31621058 | 0.90 | TDP1 (0.76) | TDP1PLCD1CA12CA1CA2 | |
| SCHEMBL13169001 | 0.90 | TDP1 (0.76) | TDP1PLCD1CA12CA1CA2 | |
| SCHEMBL19069314 | 0.90 | TDP1 (0.76) | TDP1PLCD1CA12CA1CA2 | |
| SCHEMBL18025829 | 0.90 | TDP1 (0.76) | TDP1PLCD1CA12CA1CA2 | |
| SCHEMBL24750115 | 0.90 | TDP1 (0.76) | TDP1PLCD1CA12CA1CA2 | |
| SCHEMBL5841368 | 0.90 | TDP1 (0.76) | TDP1PLCD1CA12CA1CA2 | |
| SCHEMBL18779801 | 0.89 | TDP1 (0.78) | TDP1PLCD1CA12CA1CA2 | |
| SCHEMBL8508187 | 0.89 | TDP1 (0.71) | TDP1PLCD1CNR1CA12CA1 | |
| SCHEMBL19960973 | 0.89 | TDP1 (0.74) | TDP1PLCD1CA12CA1CA2 |
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-111732584-A | Diaryl substituted fused heterocyclic compound, preparation method thereof and application thereof in pharmacy | 复旦大学 | 2020-10-02 | — | — | CN | disclosed |