Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.61 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.50 |
| ▸ | GNAI3 | P08754 | 3/20 | 0.49 |
| ▸ | GNAO1 | P09471 | 3/20 | 0.49 |
| ▸ | GNAI1 | P63096 | 3/20 | 0.49 |
| ▸ | CASP2 | P42575 | 1/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 5/20 | 0.48 |
| ▸ | NAAA | Q02083 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | PRCP | P42785 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10687011 | 0.97 | SIGMAR1 (0.65) | SIGMAR1CHRM5CHRM3GNAI3GNAO1 | |
| SCHEMBL8395095 | 0.94 | SIGMAR1 (0.65) | SIGMAR1CHRM5CHRM3GNAI3GNAO1 | |
| SCHEMBL1900359 | 0.92 | SIGMAR1 (0.67) | SIGMAR1CHRM5CHRM3GNAI3GNAO1 | |
| SCHEMBL1905216 | 0.85 | SIGMAR1 (0.71) | SIGMAR1CHRM5CHRM3GNAI3GNAO1 | |
| SCHEMBL18531743 | 0.84 | ALDH1A1 (0.65) | SIGMAR1CASP2EPHX1NAAAALDH1A1 | |
| SCHEMBL8439737 | 0.84 | CASP2 (0.56) | SIGMAR1GNAI3GNAO1GNAI1CASP2 | |
| SCHEMBL31280006 | 0.83 | SIGMAR1 (0.59) | SIGMAR1CHRM5CHRM3ALDH1A1 | |
| SCHEMBL27391609 | 0.83 | CASP2 (0.53) | SIGMAR1CASP2EPHX1NAAAALDH1A1 | |
| SCHEMBL23824100 | 0.81 | CASP2 (0.51) | CASP2EPHX1NAAAALDH1A1FAAH | |
| SCHEMBL18118429 | 0.81 | CASP2 (0.51) | CASP2EPHX1NAAAALDH1A1FAAH |
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 |
|---|---|---|---|---|---|---|---|
| EP-1153029-A2 | AMPHIPATIC POLYCARBOXYLIC CHELATES AND COMPLEXES WITH PARAMAGNETIC METALS AS MRI CONTRAST AGENTS | BRACCO INTERNATIONAL B.V. (NL) | 2001-11-14 | — | — | EP | disclosed |
| WO-2000030688-A2 | AMPHIPATIC POLYCARBOXYLIC CHELATES AND COMPLEXES WITH PARAMAGNETIC METALS AS MRI CONTRAST AGENTS | BRACCO INTERNATIONAL B.V. (NL) | 2000-06-02 | — | — | WO | disclosed |