Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | NCEH1 | Q6PIU2 | 8/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2585748 | 0.81 | ALDH1A1 (0.47) | ALDH1A1HPGDHSD17B10CYP1A2THRB | |
| SCHEMBL27888680 | 0.80 | CYP1A2 (0.45) | ALDH1A1HPGDHSD17B10CYP1A2THRB | |
| SCHEMBL27720782 | 0.77 | ESR1 (0.43) | ALDH1A1HPGDHSD17B10CYP1A2THRB | |
| SCHEMBL28663782 | 0.77 | HPGD (0.42) | ALDH1A1HPGDHSD17B10CYP1A2THRB | |
| SCHEMBL9350047 | 0.76 | ALDH1A1 (0.48) | ALDH1A1HPGDHSD17B10CYP1A2THRB | |
| SCHEMBL28826343 | 0.76 | TYMS (0.50) | ALDH1A1HPGDHSD17B10CYP1A2THRB | |
| SCHEMBL28409450 | 0.76 | ALDH1A1 (0.41) | ALDH1A1HPGDHSD17B10CYP1A2THRB | |
| SCHEMBL7907367 | 0.75 | ALOX15 (0.44) | ALDH1A1HPGDHSD17B10CYP1A2THRB | |
| SCHEMBL29117836 | 0.75 | ALDH1A1 (0.40) | ALDH1A1HPGDHSD17B10CYP1A2THRB | |
| SCHEMBL27846343 | 0.75 | ALDH1A1 (0.40) | ALDH1A1HPGDHSD17B10CYP1A2THRB |
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 |
|---|---|---|---|---|---|---|---|
| CN-111514934-B | Petal-shaped zinc perylene tetracarboxylic acid supermolecule assembly photocatalytic material and preparation method thereof | 四川大学 | 2023-04-25 | — | — | CN | disclosed |