Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13461858 | 0.79 | LMNA (0.41) | CYP1A2CYP3A4HTR1ACYP2D6CYP2C9 | |
| SCHEMBL23912809 | 0.79 | CYP1A2 (0.40) | CYP1A2CYP3A4HTR1ACYP2D6CYP2C9 | |
| SCHEMBL12828097 | 0.77 | CYP3A4 (0.36) | CYP1A2CYP3A4HTR1ACYP2D6CYP2C9 | |
| SCHEMBL13678418 | 0.74 | CYP1A2 (0.37) | CYP1A2CYP3A4HTR1ACYP2D6CYP2C9 | |
| SCHEMBL11961093 | 0.71 | PDE7A (0.54) | CYP1A2CYP3A4HTR1ACYP2D6CYP2C9 | |
| SCHEMBL21205123 | 0.70 | MAPT (0.36) | CYP1A2LMNAALOX15HSD17B10MAPT | |
| SCHEMBL156450 | 0.69 | — | — | |
| SCHEMBL29352576 | 0.69 | — | — | |
| SCHEMBL256540 | 0.69 | — | — | |
| SCHEMBL24800504 | 0.68 | AR (0.39) | CYP1A2CYP3A4CYP2D6MAPTKMT2A |
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-4180438-A1 | 18F-LABELED PSMA-TARGETED PET IMAGING AGENTS | Cancer Targeted Technology LLC (US) | 2023-05-17 | — | — | EP | disclosed |