Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 9/20 | 0.51 |
| ▸ | OPRL1 | P41146 | 9/20 | 0.51 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Ethylbenzene SCHEMBL11073164 | 0.84 | OPRM1 (0.52) | OPRM1OPRL1TACR1SLC6A4 | |
| SCHEMBL11075823 | 0.84 | OPRM1 (0.49) | OPRM1OPRL1ADAM17BCHEMAOB | |
| SCHEMBL11075825 | 0.81 | OPRM1 (0.51) | OPRM1OPRL1ADAM17BCHEMAOB | |
| Ethylbenzene SCHEMBL11078303 | 0.79 | OPRM1 (0.57) | OPRM1OPRL1 | |
| Ethylbenzene SCHEMBL11066834 | 0.78 | OPRL1 (0.51) | OPRM1OPRL1KDM1ATACR1SLC6A4 | |
| SCHEMBL11070020 | 0.77 | OPRM1 (0.49) | OPRM1OPRL1ADAM17BCHEMAOB | |
| Ethylbenzene SCHEMBL11069991 | 0.77 | OPRM1 (0.47) | OPRM1OPRL1TACR1SLC6A4 | |
| SCHEMBL22112018 | 0.77 | OPRL1 (0.56) | OPRM1OPRL1BCHEMAOBKDM1A | |
| SCHEMBL11073241 | 0.76 | OPRL1 (0.49) | OPRM1OPRL1 | |
| SCHEMBL11074085 | 0.76 | ALOX5 (0.56) | OPRM1OPRL1ADAM17BCHEMAOB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4447454-A | Analgetic compounds, compositions and process of treatment | THE UPJOHN COMPANY (US) | 1984-05-08 | — | — | US | disclosed |
| US-4113866-A | ANALGETIC COMPOUNDS, COMPOSITIONS AND PROCESS OF TREATMENT | THE UPJOHN COMPANY (US) | 1978-09-12 | — | — | US | disclosed |