Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 4/20 | 0.33 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | AGER | Q15109 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Toliodium SCHEMBL7708774 | 0.94 | AGER (0.36) | GPR3CA9CA12CA1CA2 | |
| SCHEMBL7708128 | 0.91 | GPR3 (0.34) | GPR3CA9CA1CA2HTT | |
| SCHEMBL7708628 | 0.86 | HSD11B1 (0.38) | L3MBTL1SMN1; SMN2ALDH1A1MAPT | |
| Trifluoromethanesulfonic Acid SCHEMBL2851342 | 0.84 | GPR3 (0.47) | GPR3MMP2NPSR1CA9CA12 | |
| SCHEMBL7702718 | 0.81 | GPR3 (0.35) | GPR3CA9CA12CYP3A4CYP1A2 | |
| SCHEMBL7708749 | 0.81 | GPR3 (0.35) | GPR3CA9CA12CYP3A4CYP1A2 | |
| SCHEMBL7705618 | 0.80 | ALDH1A1 (0.38) | NPSR1CA9CYP3A4CYP1A2CA1 | |
| SCHEMBL7708731 | 0.77 | ALDH1A1 (0.35) | ALDH1A1 | |
| Toliodium SCHEMBL2898696 | 0.77 | GPR3 (0.44) | GPR3MMP2CA9CA12CYP3A4 | |
| SCHEMBL7702833 | 0.77 | AGER (0.36) | GPR3CA9CA12CA1CA2 |
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-6358665-B1 | ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE | CLARIANT INTERNATIONAL LTD. (CH) | 2002-03-19 | — | — | US | disclosed |
| EP-1033624-A1 | RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE | Clariant International Ltd. (CH) | 2000-09-06 | — | — | EP | disclosed |