Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL472095 | 0.81 | ALDH1A1 (0.43) | ALDH1A1OPRM1OPRD1OPRK1 | |
| SCHEMBL10855865 | 0.80 | OPRM1 (0.36) | ALDH1A1OPRM1OPRD1OPRK1 | |
| Fluoride SCHEMBL23302253 | 0.78 | ALDH1A1 (0.42) | ALDH1A1OPRM1OPRD1OPRK1 | |
| Bromide SCHEMBL7202386 | 0.78 | ALDH1A1 (0.42) | ALDH1A1OPRM1OPRD1OPRK1 | |
| SCHEMBL11501675 | 0.75 | — | — | |
| SCHEMBL19543354 | 0.75 | CYP1A2 (0.43) | ALDH1A1OPRM1OPRD1OPRK1 | |
| SCHEMBL20438366 | 0.75 | ALDH1A1 (0.40) | ALDH1A1OPRM1OPRD1OPRK1 | |
| SCHEMBL13759584 | 0.75 | CYP1A2 (0.43) | ALDH1A1OPRM1OPRD1OPRK1 | |
| SCHEMBL182433 | 0.75 | CYP1A2 (0.43) | — | |
| SCHEMBL4393982 | 0.74 | — | — |
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-4166827-A | DENTAL PLAQUE | COOPER LABORATORIES, INC. (US) | 1979-09-04 | — | — | US | disclosed |
| US-4110328-A | Bis-carbamylguanidinoazaalkane antimicrobial compounds | COOPER LABORATORIES, INC. (US) | 1978-08-29 | — | — | US | disclosed |