Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 2/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11680616 | 0.82 | CNR2 (0.47) | ALDH1A1CNR2CNR1MEN1GAA | |
| SCHEMBL11678166 | 0.79 | ACE2 (0.44) | PTPN1CNR2CNR1MEN1KMT2A | |
| SCHEMBL11680357 | 0.72 | CNR2 (0.39) | CNR2CNR1 | |
| SCHEMBL11680120 | 0.71 | DRD2 (0.33) | ALDH1A1CNR2CNR1MEN1KMT2A | |
| SCHEMBL11679187 | 0.70 | CNR2 (0.41) | CNR2CNR1 | |
| SCHEMBL11678402 | 0.68 | CNR2 (0.35) | CNR2CNR1 | |
| SCHEMBL12085062 | 0.60 | CYP19A1 (0.39) | PTPN1ALDH1A1MEN1KMT2ACYP19A1 | |
| SCHEMBL3030839 | 0.60 | ALDH1A1 (0.74) | PTPN1ALDH1A1MEN1GAAKMT2A | |
| SCHEMBL9286375 | 0.59 | CYP19A1 (0.53) | PTPN1ALDH1A1MEN1GAAKMT2A | |
| SCHEMBL28513383 | 0.56 | QDPR (0.47) | MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4020163-A | Use of heterocyclic esters of 5H-[1]benzopyrano [3,4-b]pyridines as analgesics | SHARPS ASSOCIATES (US) | 1977-04-26 | — | — | US | disclosed |