Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.30 |
| ▸ | CD44 | P16070 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22288220 | 0.83 | ALDH1A1 (0.35) | TP53TDP1ALDH1A1TSHR | |
| SCHEMBL672658 | 0.83 | CYP2A6 (0.43) | TP53TDP1CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL12344953 | 0.79 | CYP1A2 (0.30) | CYP2A6CYP1A2 | |
| Iodobenzene SCHEMBL27797193 | 0.78 | TSHR (0.42) | TP53TDP1CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL28360523 | 0.77 | ALDH1A1 (0.43) | TDP1CYP2A6CYP1A2ALDH1A1CA1 | |
| SCHEMBL19956861 | 0.76 | CXCR5 (0.35) | CYP2A6CYP1A2ALDH1A1CA1CA2 | |
| SCHEMBL19121750 | 0.76 | RAF1 (0.33) | CYP2A6CYP1A2ALDH1A1CA1CA2 | |
| SCHEMBL10038011 | 0.74 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL30332485 | 0.74 | ALDH1A1 (0.39) | TP53TDP1CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL41438 | 0.74 | ALDH1A1 (0.39) | TP53TDP1CYP2A6CYP1A2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20230227657-A1 | FLUORESCENT MACROMOLECULE AND USES THEREOF | QUEENSLAND UNIVERSITY OF TECHNOLOGY (AU) | 2023-07-20 | — | — | US | disclosed |