Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | ATP4A | P20648 | 2/20 | 0.43 |
| ▸ | ATP4B | P51164 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13303514 | 0.85 | LMNA (0.51) | LMNACYP1A2CYP2D6KMT2ATSHR | |
| SCHEMBL8361484 | 0.83 | CYP1A2 (0.54) | CYP1A2KMT2ATSHRCYP3A4ATP4A | |
| SCHEMBL8550339 | 0.82 | LMNA (0.55) | LMNACYP1A2CYP2D6KMT2ATSHR | |
| SCHEMBL28719596 | 0.82 | CYP1A2 (0.52) | CYP1A2KMT2ATSHRCYP3A4ATP4A | |
| SCHEMBL21814927 | 0.79 | CYP1A2 (0.55) | CYP1A2KMT2ATSHRCYP3A4ATP4A | |
| SCHEMBL16155847 | 0.78 | KMT2A (0.54) | LMNACYP1A2CYP2D6KMT2ATSHR | |
| SCHEMBL5946876 | 0.76 | RAB9A (0.43) | CYP1A2CYP3A4ALDH1A1NPC1RAB9A | |
| SCHEMBL8357804 | 0.76 | CSF1R (0.43) | LMNACYP1A2CYP2D6KMT2ATSHR | |
| SCHEMBL12111155 | 0.76 | TDP1 (0.57) | LMNACYP1A2CYP2D6KMT2ATSHR | |
| SCHEMBL13303547 | 0.75 | ATP4A (0.45) | LMNACYP1A2CYP2D6ALDH1A1ATP4A |
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 |