Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.75 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.75 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.75 |
| ▸ | CFTR | P13569 | 2/20 | 0.69 |
| ▸ | GOPC | Q9HD26 | 2/20 | 0.69 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
| ▸ | STAT6 | P42226 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL30638829 | 1.00 | SLC6A3 (0.75) | SLC6A3SLC6A2SLC6A4CFTRGOPC | |
| SCHEMBL2478933 | 0.93 | SLC6A3 (0.65) | SLC6A3SLC6A2SLC6A4CFTRGOPC | |
| SCHEMBL3290275 | 0.87 | SLC6A3 (1.00) | SLC6A3SLC6A2SLC6A4CFTRGOPC | |
| SCHEMBL1507962 | 0.85 | CYP19A1 (0.73) | SLC6A3SLC6A2SLC6A4CFTRGOPC | |
| Bromide SCHEMBL30297437 | 0.85 | SLC6A3 (0.95) | SLC6A3SLC6A2SLC6A4CFTRGOPC | |
| SCHEMBL6476580 | 0.82 | SLC6A2 (1.00) | SLC6A3SLC6A2SLC6A4CFTRGOPC | |
| SCHEMBL10154156 | 0.82 | SLC6A2 (0.91) | SLC6A3SLC6A2SLC6A4CFTRGOPC | |
| SCHEMBL30166037 | 0.82 | SLC6A2 (0.91) | SLC6A3SLC6A2SLC6A4CFTRGOPC | |
| Ammonia Solution, Strong SCHEMBL6000375 | 0.81 | SLC6A2 (0.95) | SLC6A3SLC6A2SLC6A4CFTRGOPC | |
| SCHEMBL17842425 | 0.79 | SLC6A2 (0.48) | SLC6A3SLC6A2SLC6A4CFTRGOPC |
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-116969879-A | Heteroaryl-containing triarylmethane compound and synthesis method thereof | 华北水利水电大学 | 2023-10-31 | — | — | CN | disclosed |