Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | METAP2 | P50579 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29520545 | 0.84 | MAPT (0.42) | MAPTCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL29520664 | 0.83 | CHRM1 (0.39) | MAPTCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL29520576 | 0.83 | IDO1 (0.31) | IDO1 | |
| SCHEMBL29521036 | 0.83 | CYP2C9 (0.36) | MAPTCYP2C9CYP2C19IDO1LMNA | |
| SCHEMBL28500399 | 0.81 | MAPT (0.43) | MAPTLMNA | |
| SCHEMBL29520828 | 0.81 | MAPT (0.45) | MAPTCYP1A2CYP2C9CYP2C19LMNA | |
| SCHEMBL29520554 | 0.81 | CHRM1 (0.37) | — | |
| SCHEMBL29520737 | 0.80 | IDO1 (0.40) | MAPTIDO1LMNA | |
| SCHEMBL29409248 | 0.78 | NPC1 (0.36) | MAPTLMNA | |
| SCHEMBL29520778 | 0.77 | CHRM1 (0.37) | LMNA |
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-112174901-B | Synthesis method and anticancer activity of 1, 3-benzodiazepine compound | 河南师范大学 | 2022-02-08 | — | — | CN | disclosed |