Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL9943417 | 0.78 | EPHX2 (0.35) | ALDH1A1LMNAKDM4EKMT2AMEN1 | |
| SCHEMBL6887802 | 0.75 | ALDH1A1 (0.52) | ALDH1A1LMNAKDM4EGLAKMT2A | |
| SCHEMBL17786248 | 0.71 | ALDH1A1 (0.52) | ALDH1A1LMNAKDM4EGLAKMT2A | |
| SCHEMBL25229553 | 0.68 | ALDH1A1 (0.63) | ALDH1A1LMNAKDM4EGLAKMT2A | |
| SCHEMBL9904076 | 0.68 | ADORA2B (0.37) | ALDH1A1KDM4EGLAKMT2AMEN1 | |
| SCHEMBL19969556 | 0.65 | ALDH1A1 (0.46) | ALDH1A1LMNAKDM4EGLAKMT2A | |
| SCHEMBL7409608 | 0.65 | HTT (0.62) | ALDH1A1LMNAKDM4EKMT2AMEN1 | |
| SCHEMBL27269701 | 0.63 | ALDH1A1 (0.47) | ALDH1A1LMNAKDM4EGLAKMT2A | |
| SCHEMBL21766227 | 0.62 | ALDH1A1 (0.38) | ALDH1A1LMNAKDM4EGLAKMT2A | |
| SCHEMBL21750588 | 0.62 | ALDH1A1 (0.43) | ALDH1A1LMNAKDM4EGLAKMT2A |
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-2465859-A1 | 8-Triazolylxanthine derivatives, processes for their production and their use as adenosine receptor antagonists | Life & Brain GmbH (DE) | 2012-06-20 | — | — | EP | disclosed |
| WO-2012076974-A1 | 8-TRIAZOLYLXANTHINE DERIVATIVES, PROCESSES FOR THEIR PRODUCTION AND THEIR USE AS ADENOSINE RECEPTOR ANTAGONISTS | LIFE & BRAIN GMBH (DE) | 2012-06-14 | — | — | WO | disclosed |