Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 5/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | TACR1 | P25103 | 4/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | CASP5 | P51878 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8974312 | 1.00 | USP2 (0.52) | USP2CYP1A2CYP2C19TACR1CYP3A4 | |
| SCHEMBL8973991 | 0.96 | USP2 (0.56) | USP2CYP1A2CYP2C19TACR1CYP3A4 | |
| SCHEMBL8973966 | 0.95 | USP2 (0.48) | USP2CYP1A2CYP2C19TACR1CYP3A4 | |
| SCHEMBL9409753 | 0.87 | TACR1 (0.45) | USP2CYP1A2CYP2C19TACR1CYP3A4 | |
| SCHEMBL8974017 | 0.86 | ALDH1A1 (0.60) | USP2CYP1A2CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL8973914 | 0.86 | TACR1 (0.49) | TACR1CYP3A4CYP2D6TSHR | |
| SCHEMBL8973982 | 0.84 | HIF1A (0.50) | USP2TACR1CYP3A4ALDH1A1KDM4E | |
| SCHEMBL8973968 | 0.83 | USP2 (0.47) | USP2CYP1A2TACR1CYP3A4CYP2D6 | |
| SCHEMBL6028265 | 0.81 | ALDH1A1 (0.67) | USP2CYP1A2CYP2C19CYP3A4CYP2D6 | |
| SCHEMBL2930604 | 0.81 | USP2 (0.59) | USP2CYP1A2CYP2C19CYP3A4CYP2D6 |
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-5536491-A | 19 F poly aza macrocyclic MRI contrast medium | TERUMO KABUSHIKI KAISHA (JP) | 1996-07-16 | — | — | US | disclosed |
| EP-0628316-A1 | 19F-MRI contrast medium, having a macrocyclic complexant moiety | TERUMO KABUSHIKI KAISHA (JP) | 1994-12-14 | — | — | EP | disclosed |