Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 5/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | AGXT | P21549 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16589112 | 0.86 | IDO1 (0.47) | CYP3A4CYP1A2CYP2D6PRMT1IDO1 | |
| SCHEMBL6578267 | 0.85 | CYP3A4 (0.62) | CYP3A4CYP1A2CYP2D6PRMT1IDO1 | |
| SCHEMBL20435360 | 0.80 | TAAR1 (0.50) | CYP3A4CYP1A2CYP2D6PRMT1IDO1 | |
| SCHEMBL11490965 | 0.77 | IDO1 (0.51) | CYP3A4CYP1A2CYP2D6PRMT1IDO1 | |
| SCHEMBL7668721 | 0.75 | IDO1 (0.52) | CYP3A4IDO1TAAR1MAOBAPP | |
| SCHEMBL8376336 | 0.74 | MEN1 (0.47) | CYP3A4CYP1A2CYP2D6PRMT1IDO1 | |
| SCHEMBL27715705 | 0.74 | IDO1 (0.45) | CYP3A4IDO1TAAR1MAOBAPP | |
| SCHEMBL7798992 | 0.74 | TAAR1 (0.44) | CYP3A4CYP1A2CYP2D6PRMT1IDO1 | |
| SCHEMBL30657036 | 0.74 | TAAR1 (0.44) | CYP3A4CYP1A2CYP2D6PRMT1IDO1 | |
| SCHEMBL4433692 | 0.73 | TAAR1 (0.53) | CYP3A4CYP1A2CYP2D6IDO1TAAR1 |
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-0750610-B1 | PIPERIDYL-4-SUBSTITUTED THYROSINE DERIVATIVES AS SCINTIGRAPHIC IMAGING AGENTS FOR THE DIAGNOSIS OF THROMBOSIS | DIATIDE INC (US) | 2001-12-12 | — | — | EP | disclosed |