Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | STAT6 | P42226 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL6984533 | 0.72 | DGAT1 (0.43) | CYP1A2CYP2C9NPSR1KDM4EALDH1A1 | |
| SCHEMBL6982954 | 0.70 | DGAT1 (0.58) | CYP1A2CYP2C9NPSR1KDM4EALDH1A1 | |
| SCHEMBL19398619 | 0.65 | KCNH2 (0.53) | ALDH1A1MEN1NPC1RAB9AKMT2A | |
| SCHEMBL311704 | 0.65 | CXCR1 (0.43) | CYP1A2CYP3A4KDM4EALDH1A1HPGD | |
| SCHEMBL13607863 | 0.64 | CYP1A2 (0.53) | PIN1CYP1A2CYP3A4CYP2C9NPSR1 | |
| SCHEMBL6651603 | 0.63 | PIN1 (0.60) | PIN1CYP1A2CYP3A4CYP2C9NPSR1 | |
| SCHEMBL11562962 | 0.63 | PIN1 (0.63) | PIN1CYP1A2CYP3A4CYP2C9NPSR1 | |
| SCHEMBL1720364 | 0.63 | CYP1A2 (0.55) | PIN1CYP1A2CYP3A4CYP2C9NPSR1 | |
| SCHEMBL24074350 | 0.62 | NPBWR1 (0.59) | PIN1CYP1A2CYP3A4CYP2C9NPSR1 | |
| SCHEMBL20445314 | 0.62 | MAPK14 (0.61) | PIN1CYP1A2CYP3A4CYP2C9NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1224180-A2 | SUBSTITUTED AZOLES | Novartis AG (CH) | 2002-07-24 | — | — | EP | disclosed |
| WO-2000063204-A2 | SUBSTITUTED AZOLES | NOVARTIS AG (CH) | 2000-10-26 | — | — | WO | disclosed |