Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 6/20 | 0.43 |
| ▸ | CTSG | P08311 | 3/20 | 0.43 |
| ▸ | POLM | Q9NP87 | 2/20 | 0.43 |
| ▸ | POLK | Q9UBT6 | 2/20 | 0.43 |
| ▸ | POLL | Q9UGP5 | 2/20 | 0.43 |
| ▸ | POLH | Q9Y253 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | TYR | P14679 | 2/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL28357045 | 1.00 | ELANE (0.43) | ELANECTSGPOLMPOLKPOLL | |
| SCHEMBL23271654 | 0.78 | POLM (0.51) | ELANECTSGPOLMPOLKPOLL | |
| SCHEMBL30003055 | 0.78 | POLM (0.51) | ELANECTSGPOLMPOLKPOLL | |
| SCHEMBL1864583 | 0.77 | ELANE (0.42) | ELANECTSGTYRNR1H2NR1H3 | |
| SCHEMBL11708641 | 0.77 | ELANE (0.45) | ELANECTSGTYRNR1H2NR1H3 | |
| SCHEMBL11328017 | 0.75 | TYR (0.57) | ACHETYRMEN1TP53CYP3A4 | |
| SCHEMBL11331495 | 0.75 | TYR (0.57) | ACHETYRMEN1TP53CYP3A4 | |
| SCHEMBL11337178 | 0.75 | TYR (0.57) | ACHETYRMEN1TP53CYP3A4 | |
| SCHEMBL30876168 | 0.75 | TYR (0.57) | ACHETYRMEN1TP53CYP3A4 | |
| SCHEMBL7571565 | 0.75 | TYR (0.57) | ACHETYRMEN1TP53CYP3A4 |
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-110642695-A | N-type star polycyclic conjugated aromatic hydrocarbon and synthetic method thereof | 重庆工商大学 | 2020-01-03 | — | — | CN | disclosed |