Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL27676667 | 0.98 | OPRM1 (0.39) | OPRM1SHBGCYP1A2SPHK1 | |
| SCHEMBL9204420 | 0.98 | SHBG (0.43) | OPRM1SHBGCYP1A2 | |
| SCHEMBL9202942 | 0.98 | OPRM1 (0.39) | OPRM1SHBGCYP1A2SPHK1 | |
| SCHEMBL9206536 | 0.98 | OPRM1 (0.39) | OPRM1SHBGCYP1A2SPHK1 | |
| SCHEMBL327325 | 0.98 | OPRM1 (0.39) | OPRM1SHBGCYP1A2SPHK1 | |
| SCHEMBL11677493 | 0.96 | SHBG (0.41) | SHBGCYP1A2 | |
| SCHEMBL4490677 | 0.96 | SHBG (0.41) | SHBGCYP1A2 | |
| SCHEMBL4723686 | 0.96 | SHBG (0.41) | SHBGCYP1A2 | |
| SCHEMBL9213061 | 0.96 | SHBG (0.41) | SHBGCYP1A2 | |
| SCHEMBL3421946 | 0.96 | SHBG (0.41) | SHBGCYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0421441-B1 | Pantothenic acid derivatives | FUJIREBIO KK (JP) | 1995-01-25 | — | — | EP | disclosed |
| US-5120738-A | Cardiovascular disorders | FUJIREBIO INC. (JP) | 1992-06-09 | — | — | US | disclosed |
| EP-0421441-A2 | Pantothenic acid derivatives | FUJIREBIO INC. (JP) | 1991-04-10 | — | — | EP | disclosed |