Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL8311343 | 0.80 | ALDH1A1 (0.44) | KDM4EKMT2AOPRM1 | |
| SCHEMBL8487791 | 0.78 | KDM4E (0.36) | KDM4EKMT2ACYP1A2OPRM1SIGMAR1 | |
| SCHEMBL28609456 | 0.78 | KDM4E (0.41) | KDM4EKMT2ACYP1A2 | |
| SCHEMBL3852438 | 0.77 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL28777414 | 0.77 | KDM4E (0.35) | KDM4EKMT2AOPRM1SIGMAR1 | |
| SCHEMBL27847843 | 0.75 | ALDH1A1 (0.40) | KDM4EKMT2AOPRM1 | |
| SCHEMBL28515873 | 0.74 | KDM4E (0.41) | KDM4EKMT2A | |
| SCHEMBL13041666 | 0.72 | — | — | |
| SCHEMBL854175 | 0.70 | KDM4E (0.41) | KDM4EKMT2ACYP1A2OPRM1SIGMAR1 | |
| SCHEMBL7625133 | 0.67 | NPSR1 (0.33) | — |
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-2054053-A1 | BIPHENYL SUBSTITUTED SPIROTETRONIC ACIDS AND THEIR USE FOR THE TREATMENT OF RETROVIRAL DISORDERS | AiCuris GmbH & Co. KG (DE) | 2009-05-06 | — | — | EP | disclosed |
| WO-2008022725-A1 | BIPHENYL SUBSTITUTED SPIROTETRONIC ACIDS AND THEIR USE FOR THE TREATMENT OF RETROVIRAL DISORDERS | AICURIS GMBH & CO. KG (DE) | 2008-02-28 | — | — | WO | disclosed |