Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 6/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | NAA50 | Q9GZZ1 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | APLNR | P35414 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21581730 | 0.92 | CAPN1 (0.46) | CAPN1OPRM1OPRD1CTSBNAA50 | |
| SCHEMBL21581718 | 0.84 | CAPN1 (0.43) | CAPN1OPRM1OPRD1CTSBAPLNR | |
| SCHEMBL26454162 | 0.82 | CAPN1 (0.45) | CAPN1OPRM1OPRD1CTSB | |
| SCHEMBL21581703 | 0.82 | CAPN1 (0.45) | CAPN1OPRM1OPRD1CTSB | |
| SCHEMBL30480787 | 0.81 | OPRM1 (0.43) | OPRM1OPRD1APLNR | |
| SCHEMBL10703833 | 0.81 | OPRM1 (0.42) | CAPN1OPRM1OPRD1CTSB | |
| SCHEMBL30872268 | 0.78 | CAPN1 (0.46) | CAPN1CTSB | |
| SCHEMBL9293413 | 0.78 | CXCR4 (0.48) | OPRM1OPRD1 | |
| SCHEMBL29934618 | 0.78 | OPRM1 (0.51) | OPRM1OPRD1APLNR | |
| SCHEMBL30264441 | 0.77 | OPRM1 (0.42) | OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019222805-A1 | NEW SYNTHETIC METHODS USING NATIVE CHEMICAL LIGATION IN FLOW | THE UNIVERSITY OF SYDNEY (AU) | 2019-11-28 | — | — | WO | disclosed |