Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.35 |
| ▸ | ALPL | P05186 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6609609 | 1.00 | CYP1A2 (0.39) | CYP1A2RAB9AKMT2APDE10AALPL | |
| SCHEMBL6403781 | 0.95 | CYP1A2 (0.36) | CYP1A2RAB9AKMT2APDE10AALPL | |
| Hydrochloric Acid SCHEMBL6399825 | 0.93 | CYP1A2 (0.37) | CYP1A2RAB9AKMT2APDE10AALPL | |
| SCHEMBL6404062 | 0.92 | CYP1A2 (0.38) | CYP1A2RAB9AKMT2APDE10AALPL | |
| SCHEMBL6404069 | 0.92 | CYP1A2 (0.38) | CYP1A2RAB9AKMT2APDE10AALPL | |
| SCHEMBL6607771 | 0.89 | MMP2 (0.38) | CYP1A2RAB9AKMT2APDE10AALPL | |
| SCHEMBL6607764 | 0.89 | MMP2 (0.38) | CYP1A2RAB9AKMT2APDE10AALPL | |
| SCHEMBL6987897 | 0.89 | MMP2 (0.35) | CYP1A2RAB9AKMT2ALMNAPOLB | |
| SCHEMBL6400327 | 0.89 | CYP1A2 (0.38) | CYP1A2RAB9AKMT2APDE10AALPL | |
| SCHEMBL6400334 | 0.89 | CYP1A2 (0.38) | CYP1A2RAB9AKMT2APDE10AALPL |
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 |
|---|---|---|---|---|---|---|---|
| EP-1289980-B1 | BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES | SMITHKLINE BEECHAM PLC (GB) | 2004-11-17 | — | — | EP | disclosed |