Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 8/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.45 |
| ▸ | MME | P08473 | 2/20 | 0.45 |
| ▸ | ACE | P12821 | 2/20 | 0.45 |
| ▸ | CPA1 | P15085 | 2/20 | 0.45 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.45 |
| ▸ | CCKAR | P32238 | 3/20 | 0.44 |
| ▸ | CCKBR | P32239 | 3/20 | 0.44 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.44 |
| ▸ | FCER2 | P06734 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.44 |
| ▸ | CD40 | P25942 | 2/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.42 |
| ▸ | CHRNG | P07510 | 1/20 | 0.42 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.42 |
| ▸ | CHRND | Q07001 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31167405 | 0.91 | MME (0.50) | OPRD1MMP2MMEACECPA1 | |
| SCHEMBL30609954 | 0.91 | MMP2 (0.55) | OPRD1MMP2MMEOPRM1CD40 | |
| SCHEMBL30609948 | 0.91 | MMP2 (0.55) | OPRD1MMP2MMEOPRM1CD40 | |
| SCHEMBL30609971 | 0.86 | CD40 (0.48) | OPRD1MMP2CCKARCCKBROPRM1 | |
| SCHEMBL30609961 | 0.86 | CD40 (0.47) | OPRD1MMP2ACECCKARCCKBR | |
| SCHEMBL29616642 | 0.85 | MME (0.57) | MMP2MMEACECPA1ACE2 | |
| SCHEMBL31415945 | 0.83 | CD40 (0.52) | OPRD1CCKARCCKBROPRM1CD40 | |
| SCHEMBL31138053 | 0.82 | MMP2 (0.54) | OPRD1MMP2FOLH1OPRM1CD40 | |
| SCHEMBL30179134 | 0.82 | GNPAT (0.52) | OPRD1MMP2MMEACECPA1 | |
| SCHEMBL31167399 | 0.81 | MMP2 (0.57) | MMP2MMEOPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116970040-A | Opioid multi-target-spot cyclohexapeptide molecule with amide bond ring formation, and preparation and application thereof | 兰州大学 | 2023-10-31 | — | — | CN | claimed |
| CN-116970040-A | Opioid multi-target-spot cyclohexapeptide molecule with amide bond ring formation, and preparation and application thereof | 兰州大学 | 2023-10-31 | — | — | CN | disclosed |