Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | PRCP | P42785 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9632957 | 0.78 | SLC6A3 (0.34) | OPRM1OPRL1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL9631609 | 0.75 | KMT2A (0.45) | MEN1KMT2ALMNATSHRHCAR2 | |
| SCHEMBL9633103 | 0.74 | OPRM1 (0.38) | OPRM1OPRL1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL9633719 | 0.73 | SLC6A2 (0.34) | OPRM1OPRL1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL11315800 | 0.71 | — | — | |
| SCHEMBL9632050 | 0.71 | — | — | |
| SCHEMBL9631477 | 0.71 | — | — | |
| SCHEMBL15898588 | 0.71 | SLC6A3 (0.40) | OPRM1OPRL1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL9633434 | 0.69 | SLC6A3 (0.35) | OPRM1OPRL1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL19796074 | 0.68 | SLC6A3 (0.53) | OPRM1OPRL1SLC6A3SLC6A2SLC6A4 |
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-5120861-A | DIAZIRINE DERIVATIVES OF AROMATIC HETEROCYCLIC COMPOUNDS | SHELL RESEARCH LIMITED (GB) | 1992-06-09 | — | — | US | disclosed |
| EP-0432817-A1 | Diazirine derivatives of aromatic heterocyclic compounds | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1991-06-19 | — | — | EP | disclosed |