Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL31055584 | 0.89 | MAPT (0.40) | MAPTHDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL3620419 | 0.85 | SLC6A5 (0.41) | MAPTLMNACYP3A4SLC6A2CYP2C19 | |
| SCHEMBL2989940 | 0.83 | GABRR1 (0.44) | HDAC6HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL13969979 | 0.83 | MAPT (0.44) | MAPTLMNAPGRADORA3CYP2C9 | |
| SCHEMBL9859616 | 0.82 | MAPT (0.39) | MAPTHDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL9859623 | 0.82 | MAPT (0.39) | MAPTHDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL5983589 | 0.80 | CTSK (0.40) | MAPTHDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL5983587 | 0.80 | CTSK (0.40) | MAPTHDAC6HDAC3HDAC1HDAC2 | |
| SCHEMBL10310662 | 0.78 | MAPT (0.44) | MAPTLMNAPGRCYP3A4ADORA3 | |
| SCHEMBL8623665 | 0.78 | PPARG (0.41) | MAPTHDAC6HDAC3HDAC1HDAC2 |
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-113943259-A | Amino acid derivative, preparation method and application thereof | 西安禾渼生物医药有限公司 | 2022-01-18 | — | — | CN | disclosed |