Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RELA | Q04206 | 2/20 | 0.50 |
| ▸ | AHR | P35869 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 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 | |
|---|---|---|---|---|
| SCHEMBL5492879 | 0.70 | AHR (0.74) | RELAAHRKDM4ENPC1RAB9A | |
| SCHEMBL5492873 | 0.70 | AHR (0.74) | RELAAHRKDM4ENPC1RAB9A | |
| SCHEMBL18416525 | 0.70 | AHR (0.74) | RELAAHRKDM4ENPC1RAB9A | |
| SCHEMBL5494962 | 0.68 | RELA (1.00) | RELAAHRCYP1A2NFE2L2ESR1 | |
| SCHEMBL5494969 | 0.68 | RELA (1.00) | RELAAHRCYP1A2NFE2L2ESR1 | |
| SCHEMBL8047156 | 0.67 | HCAR1 (0.42) | MAPTNPC1SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6208861 | 0.67 | NPC1 (0.48) | AHRMAPTKDM4ENPC1RAB9A | |
| SCHEMBL6208862 | 0.67 | NPC1 (0.48) | AHRMAPTKDM4ENPC1RAB9A | |
| SCHEMBL6471614 | 0.66 | AHR (1.00) | RELAAHRKDM4ECYP1A2NFE2L2 | |
| SCHEMBL6461016 | 0.66 | AHR (1.00) | RELAAHRKDM4ECYP1A2NFE2L2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004071447-A9 | SUBSTITUTED AZOLE DERIVATIVES AS THERAPEUTIC AGENTS | TRANSTECH PHARMA INC (US) | 2005-10-13 | — | — | WO | disclosed |