Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 4/20 | 0.46 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 2/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.42 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | PRKCI | P41743 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2600025 | 1.00 | IKBKB (0.50) | IKBKBHDAC4HDAC2HDAC8ACHE | |
| SCHEMBL2608414 | 0.88 | PRKCI (0.53) | IKBKBHDAC4HDAC2HDAC8ACHE | |
| SCHEMBL27957352 | 0.87 | ESR1 (0.50) | IKBKBENPP2PRSS1PRSS2PRSS3 | |
| SCHEMBL2636462 | 0.85 | PDK1 (0.44) | IKBKBENPP2PRSS1PRSS2PRSS3 | |
| SCHEMBL2692186 | 0.83 | PDK1 (0.46) | IKBKBENPP2PRSS1PRSS2PRSS3 | |
| SCHEMBL18766215 | 0.83 | CYP1A2 (0.47) | IKBKBENPP2PRSS1PRSS2PRSS3 | |
| SCHEMBL475557 | 0.83 | TDP1 (0.46) | HDAC4HDAC2HDAC8ACHEBCHE | |
| SCHEMBL1653927 | 0.82 | KIF11 (0.49) | HDAC4HDAC2HDAC8ACHEBCHE | |
| SCHEMBL5433184 | 0.82 | ACHE (0.46) | HDAC4HDAC2HDAC8ACHEBCHE | |
| SCHEMBL30573009 | 0.82 | KIF11 (0.49) | HDAC4HDAC2HDAC8ACHEBCHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118955244-A | Method for preparing primary alcohol by homogeneously catalyzing and reducing carboxylic acid derivative by using N-heterocyclic carbene copper complex | 延安大学 | 2024-11-15 | — | — | CN | disclosed |
| WO-2023069700-A1 | COMPOUNDS THAT MEDIATE PROTEIN DEGRADATION AND METHODS OF USE THEREOF | MONTE ROSA THERAPEUTICS, INC. (US) | 2023-04-27 | — | — | WO | disclosed |