Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | AGER | Q15109 | 6/20 | 0.40 |
| ▸ | EBP | Q15125 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | ATP4A | P20648 | 1/20 | 0.40 |
| ▸ | ATP4B | P51164 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | LSS | P48449 | 2/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8359651 | 0.93 | HTT (0.64) | HTTLMNACYP1A2CYP2D6AGER | |
| SCHEMBL8361490 | 0.92 | LMNA (0.53) | HTTLMNACYP1A2CYP2D6AGER | |
| SCHEMBL8361945 | 0.87 | LMNA (0.51) | HTTLMNACYP1A2CYP2D6AGER | |
| SCHEMBL8356218 | 0.85 | LMNA (0.60) | HTTLMNACYP1A2CYP2D6AGER | |
| SCHEMBL8359567 | 0.83 | AURKB (0.45) | HTTLMNACYP1A2CYP2D6ATP4A | |
| SCHEMBL8552900 | 0.82 | LMNA (0.53) | HTTLMNACYP1A2CYP2D6LTA4H | |
| SCHEMBL8357762 | 0.81 | LMNA (0.49) | HTTLMNACYP1A2CYP2D6ACHE | |
| SCHEMBL8358021 | 0.81 | HTT (0.44) | HTTATP4AATP4BLOXL2 | |
| SCHEMBL8551252 | 0.80 | LMNA (0.50) | HTTLMNACYP1A2CYP2D6ATP4A | |
| SCHEMBL8355859 | 0.80 | AURKB (0.49) | HTTLMNACYP1A2CYP2D6AURKB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5919807-A | ANTICHOLESTEROL AGENTS | DR. KARL THOMAE GMBH (DE) | 1999-07-06 | — | — | US | disclosed |
| EP-0824529-A1 | BENZOTHIAZOLES AND BENZOXAZOLES, AS WELL AS DRUGS CONTAINING THEM, THEIR USE AND METHODS OF PREPARING THEM | Dr. Karl Thomae GmbH (DE) | 1998-02-25 | — | — | EP | disclosed |
| WO-1996035681-A1 | BENZOTHIAZOLES AND BENZOXAZOLES, AS WELL AS DRUGS CONTAINING THEM, THEIR USE AND METHODS OF PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1996-11-14 | — | — | WO | disclosed |