Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | FDPS | P14324 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3606954 | 1.00 | AHR (0.48) | AHRKDM4EENPP2TSHRFDPS | |
| SCHEMBL3606956 | 1.00 | AHR (0.48) | AHRKDM4EENPP2TSHRFDPS | |
| SCHEMBL3599936 | 0.86 | AHR (0.36) | AHRKDM4EENPP2FDPS | |
| SCHEMBL3599934 | 0.86 | AHR (0.36) | AHRKDM4EENPP2FDPS | |
| SCHEMBL502081 | 0.81 | KDM4E (0.36) | AHRKDM4EENPP2FDPSMAPT | |
| SCHEMBL502080 | 0.81 | KDM4E (0.36) | AHRKDM4EENPP2FDPSMAPT | |
| SCHEMBL6222770 | 0.79 | ENPP2 (0.56) | KDM4EENPP2MAPTLMNAGAA | |
| SCHEMBL6222767 | 0.79 | ENPP2 (0.56) | KDM4EENPP2MAPTLMNAGAA | |
| SCHEMBL3921456 | 0.78 | VCAM1 (0.41) | KDM4ETSHRMAPTLMNAALDH1A1 | |
| SCHEMBL3921458 | 0.78 | VCAM1 (0.41) | KDM4ETSHRMAPTLMNAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1214322-A2 | AMINO-TRIAZOLOPYRIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-06-19 | — | — | EP | disclosed |
| US-6355653-B1 | DRUG AND CARRIER FOR ANTIALLERGENS, BRAIN DISORDERS AND NEUROTRANSMITTERS | HOFFMANN-LA ROCHE INC. | 2002-03-12 | — | — | US | disclosed |
| WO-2001017999-A2 | AMINO-TRIAZOLOPYRIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-03-15 | — | — | WO | disclosed |