Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | FTO | Q9C0B1 | 9/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.50 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.50 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7864064 | 0.95 | FTO (0.55) | CYP3A4FTOHPGDMAPTMEN1 | |
| SCHEMBL5176015 | 0.85 | FTO (0.51) | CYP3A4FTOHPGDMAPTMEN1 | |
| SCHEMBL3164943 | 0.84 | CYP3A4 (0.87) | CYP3A4FTOHPGDMAPTMEN1 | |
| SCHEMBL11666220 | 0.82 | FTO (0.59) | CYP3A4FTOHPGDMAPTMEN1 | |
| Naphthalene SCHEMBL3166641 | 0.81 | CYP3A4 (0.81) | CYP3A4FTOHPGDMAPTMEN1 | |
| SCHEMBL2314510 | 0.79 | FTO (0.60) | CYP3A4FTOHPGDMAPTMEN1 | |
| SCHEMBL385190 | 0.78 | HPGD (0.53) | CYP3A4FTOHPGDMAPTMEN1 | |
| SCHEMBL393726 | 0.78 | FTO (0.47) | CYP3A4FTOHPGDMAPTMEN1 | |
| SCHEMBL6685820 | 0.78 | FTO (0.53) | CYP3A4FTOHPGDMAPTMEN1 | |
| SCHEMBL5181388 | 0.77 | FTO (0.47) | CYP3A4FTOHPGDMAPTMEN1 |
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-6420131-B1 | MONITORING PREFRENTIAL ENZYMATIC ACTIVITY; OBTAIN SAMPLE OF ENZYMATIC POLYPEPTIDE, INCUBATE WITH MODULATOR, EVALUATE THE MODULATOR ABILITY TO INHIBIT ENZYMATIC POLYPEPTIDE | GENTEST CORPORATION | 2002-07-16 | — | — | US | disclosed |
| EP-1210342-A1 | THE USE OF FLUORESCEIN ARYL ETHERS IN HIGH THROUGHPUT CYTOCHROME P450 INHIBITION ASSAYS | GENTEST CORPORATION (US) | 2002-06-05 | — | — | EP | disclosed |
| WO-2001014361-A1 | THE USE OF FLUORESCEIN ARYL ETHERS IN HIGH THROUGHPUT CYTOCHROME P450 INHIBITION ASSAYS | GENTEST CORPORATION (US) | 2001-03-01 | — | — | WO | disclosed |