Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.33 |
| ▸ | ABAT | P80404 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL31265582 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TDP1TAS1R3TAS1R1TSHR | |
| SCHEMBL38133 | 0.84 | ALDH1A1 (0.58) | ALDH1A1TDP1TAS1R3TAS1R1TSHR | |
| SCHEMBL39787 | 0.77 | ALDH1A1 (0.61) | ALDH1A1TDP1TSHRLMNAHPGD | |
| SCHEMBL4900360 | 0.75 | ALDH1A1 (0.67) | ALDH1A1TDP1TAS1R3TAS1R1LMNA | |
| SCHEMBL27324591 | 0.75 | SRD5A2 (0.57) | ALDH1A1TSHRHPGDSRD5A2HTT | |
| SCHEMBL3753579 | 0.75 | ALDH1A1 (0.58) | ALDH1A1TDP1TAS1R3TAS1R1TSHR | |
| SCHEMBL16536 | 0.73 | ALDH1A1 (0.62) | ALDH1A1TDP1TSHRHPGDMAPT | |
| SCHEMBL781741 | 0.73 | ALDH1A1 (0.55) | ALDH1A1TDP1TAS1R3TAS1R1TSHR | |
| SCHEMBL3628542 | 0.73 | ALDH1A1 (0.55) | ALDH1A1TDP1TAS1R3TAS1R1TSHR | |
| SCHEMBL4805920 | 0.72 | RAB9A (0.60) | ALDH1A1TDP1TSHRLMNAHPGD |
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-118812803-A | 2D COFs material based on flexible building blocks and preparation method and application thereof | 海南大学 | 2024-10-22 | — | — | CN | disclosed |