Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.46 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11566308 | 0.95 | CA12 (0.47) | OPRM1KCNH2SIGMAR1CA12CA1 | |
| SCHEMBL11563362 | 0.89 | DRD3 (0.53) | OPRM1KCNH2SIGMAR1OPRL1CA12 | |
| SCHEMBL11565284 | 0.86 | KCNA3 (0.51) | OPRM1KCNH2OPRL1CA12CA1 | |
| SCHEMBL11563820 | 0.84 | CA12 (0.47) | OPRM1SIGMAR1CA12CA1CA2 | |
| SCHEMBL11567575 | 0.82 | CA12 (0.48) | OPRM1OPRL1CA12CA1CA2 | |
| SCHEMBL9152974 | 0.82 | CA12 (0.61) | OPRM1KCNH2SIGMAR1CA12CA1 | |
| SCHEMBL11566590 | 0.82 | CA12 (0.47) | OPRM1KCNH2CA12CA1CA2 | |
| SCHEMBL13490813 | 0.80 | CACNA1C (0.51) | OPRM1CA12CA1CA2CA4 | |
| SCHEMBL11567027 | 0.77 | CA12 (0.59) | OPRM1KCNH2SIGMAR1CA12CA1 | |
| SCHEMBL11567149 | 0.77 | CA12 (0.51) | OPRM1SIGMAR1CA12CA1CA2 |
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-4179569-A | ANALGESIC INTERMEDIATES | JANSSEN PHARMACEUTICA N.V. (BE) | 1979-12-18 | — | — | US | disclosed |