Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24518166 | 0.85 | RAB9A (0.46) | RAB9ANPC1TSHRHDAC8CYP1A2 | |
| SCHEMBL24518324 | 0.82 | ALDH1A1 (0.38) | MAPTTSHRCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL25399866 | 0.81 | CASP1 (0.43) | RAB9ANPC1TP53MAPTHPGD | |
| SCHEMBL25399858 | 0.81 | CASP1 (0.43) | RAB9ANPC1TP53MAPTHPGD | |
| SCHEMBL25400119 | 0.80 | P2RY12 (0.51) | RAB9ANPC1TP53MAPTHPGD | |
| SCHEMBL24518121 | 0.78 | F10 (0.54) | RAB9ANPC1HPGDTSHRCYP1A2 | |
| SCHEMBL24518101 | 0.74 | ALDH1A1 (0.46) | RAB9AMAPTHPGDTSHRCYP1A2 | |
| SCHEMBL24518109 | 0.74 | ALDH1A1 (0.50) | RAB9AMAPTHPGDTSHRCYP1A2 | |
| SCHEMBL24518120 | 0.72 | LMNA (0.42) | NPC1HPGDTSHRCYP1A2CYP2D6 | |
| SCHEMBL29847201 | 0.71 | NPC1 (0.51) | RAB9ANPC1TSHRHDAC8CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022123530-A1 | BORONIC ACID COMPOUND | 주식회사 엘지화학 | 2022-06-16 | — | — | WO | disclosed |