Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 4/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 7/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 6/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | AKT1 | P31749 | 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 | |
|---|---|---|---|---|
| SCHEMBL21581718 | 0.92 | CAPN1 (0.43) | CAPN1OPRM1OPRD1CTSB | |
| SCHEMBL21581730 | 0.85 | CAPN1 (0.46) | CAPN1OPRM1OPRD1CTSB | |
| SCHEMBL21581719 | 0.84 | OPRM1 (0.51) | OPRM1OPRD1 | |
| SCHEMBL21581721 | 0.77 | OPRM1 (0.52) | OPRM1OPRD1OPRK1 | |
| SCHEMBL21581705 | 0.76 | CAPN1 (0.44) | CAPN1OPRM1OPRD1CTSB | |
| SCHEMBL30167067 | 0.75 | ACE (0.48) | OPRM1OPRD1 | |
| SCHEMBL21581709 | 0.75 | OPRM1 (0.58) | OPRM1OPRD1 | |
| SCHEMBL31259022 | 0.75 | CAPN1 (0.52) | CAPN1OPRM1OPRD1CTSB | |
| SCHEMBL26454172 | 0.75 | OPRM1 (0.58) | OPRM1OPRD1 | |
| SCHEMBL29760883 | 0.74 | CAPN1 (0.55) | CAPN1OPRM1OPRD1CTSB |
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 |