Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 4/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.31 |
| ▸ | CDK9 | P50750 | 1/20 | 0.31 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.31 |
| ▸ | CCR1 | P32246 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
| ▸ | CCR8 | P51685 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2260538 | 0.74 | CHRNB2 (0.32) | — | |
| SCHEMBL1802080 | 0.72 | MEN1 (0.42) | CYP2A6ERN1MEN1LMNATHRB | |
| SCHEMBL7489384 | 0.70 | ERN1 (0.61) | CYP2A6ERN1 | |
| SCHEMBL2424888 | 0.69 | KDM4E (0.31) | — | |
| SCHEMBL14917840 | 0.69 | — | — | |
| SCHEMBL10560214 | 0.69 | ASIC3 (0.33) | MEN1KMT2A | |
| SCHEMBL31141575 | 0.69 | CYP2A6 (0.52) | CYP2A6ERN1MEN1KMT2A | |
| SCHEMBL4348787 | 0.69 | ERN1 (0.41) | CYP2A6ERN1 | |
| SCHEMBL4987157 | 0.69 | GSK3A (0.33) | — | |
| SCHEMBL17935116 | 0.69 | GSK3A (0.31) | CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022089514-A1 | POLYCYCLIC BIOREGULATOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 上海翰森生物医药科技有限公司 | 2022-05-05 | — | — | WO | disclosed |