Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | DRD2 | P14416 | 4/20 | 0.44 |
| ▸ | DRD4 | P21917 | 4/20 | 0.44 |
| ▸ | DRD3 | P35462 | 4/20 | 0.44 |
| ▸ | CA1 | P00915 | 4/20 | 0.42 |
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.42 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | GBA1 | P04062 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9550978 | 0.92 | ALDH1A1 (0.50) | ALDH1A1DRD2DRD4DRD3CA1 | |
| SCHEMBL28629399 | 0.84 | ALDH1A1 (0.44) | ALDH1A1DRD2DRD4DRD3CA1 | |
| SCHEMBL14219017 | 0.84 | ALDH1A1 (0.47) | ALDH1A1DRD2DRD4DRD3CA1 | |
| SCHEMBL1687895 | 0.83 | ALDH1A1 (0.44) | ALDH1A1CA1CA12CA9STAT3 | |
| SCHEMBL3975259 | 0.83 | CA1 (0.47) | ALDH1A1CA1CA12CA9STAT3 | |
| SCHEMBL23296190 | 0.83 | ALDH1A1 (0.57) | ALDH1A1DRD2DRD4DRD3CA1 | |
| SCHEMBL20856190 | 0.82 | ALDH1A1 (0.43) | ALDH1A1CA1CA12CA9STAT3 | |
| Hydrochloric Acid SCHEMBL28969274 | 0.82 | ALDH1A1 (0.43) | ALDH1A1CA1CA12CA9STAT3 | |
| SCHEMBL7535395 | 0.81 | ALDH1A1 (0.42) | ALDH1A1CA1CA12CA9STAT3 | |
| SCHEMBL8343815 | 0.81 | ALDH1A1 (0.42) | ALDH1A1CA1CA12CA9STAT3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5417960-A | Gadolinium complexes, magnetic resonance imaging | GUERBET S.A. (FR) | 1995-05-23 | — | — | US | disclosed |
| EP-0365412-B1 | Cyclic nitrogen-containing ligands, their metal complexes, diagnostic compositions containing these complexes and method of preparing the ligands | GUERBET SA (FR) | 1995-05-17 | — | — | EP | disclosed |
| EP-0287465-B1 | CYCLIC LIGANDS CONTAINING NITROGEN, METAL COMPLEXES FORMED BY THESE LIGANDS, DIAGNOSTIC COMPOSITIONS CONTAINING THEM AND PROCESS FOR THEIR PREPARATION | GUERBET S.A. (FR) | 1993-01-27 | — | — | EP | disclosed |
| EP-0365412-A1 | Cyclic nitrogen-containing ligands, their metal complexes, diagnostic compositions containing these complexes and method of preparing the ligands | GUERBET S.A. (FR) | 1990-04-25 | — | — | EP | disclosed |
| EP-0287465-A1 | Cyclic ligands containing nitrogen, metal complexes formed by these ligands, diagnostic compositions containing them and process for their preparation | GUERBET S.A. (FR) | 1988-10-19 | — | — | EP | disclosed |