Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 6/20 | 0.45 |
| ▸ | USP2 | O75604 | 6/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP5 | P51878 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8973698 | 0.87 | USP2 (0.52) | TACR1USP2CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL8974312 | 0.87 | USP2 (0.52) | TACR1USP2CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL8973991 | 0.83 | USP2 (0.56) | TACR1USP2CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL8973966 | 0.83 | USP2 (0.48) | TACR1USP2CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL9409749 | 0.76 | FPR2 (0.50) | TACR1USP2CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL8974017 | 0.75 | ALDH1A1 (0.60) | USP2CYP1A2CYP2C19CYP3A4TSHR | |
| SCHEMBL8973914 | 0.75 | TACR1 (0.49) | TACR1CYP3A4TSHRCYP2D6 | |
| SCHEMBL8973982 | 0.73 | HIF1A (0.50) | TACR1USP2CYP3A4ALDH1A1HIF1A | |
| SCHEMBL8973968 | 0.72 | USP2 (0.47) | TACR1USP2CYP1A2CYP3A4TSHR | |
| SCHEMBL6028265 | 0.71 | ALDH1A1 (0.67) | USP2CYP1A2CYP2C19CYP3A4TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0628316-A1 | 19F-MRI contrast medium, having a macrocyclic complexant moiety | TERUMO KABUSHIKI KAISHA (JP) | 1994-12-14 | — | — | EP | disclosed |