Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2332793 | 0.76 | RAB9A (0.46) | ALDH1A1KDM4EL3MBTL1ADORA2AADORA2B | |
| SCHEMBL1553629 | 0.67 | PDE4D (0.65) | ALDH1A1KDM4EL3MBTL1ADORA2AADORA2B | |
| SCHEMBL2454564 | 0.67 | PBK (0.45) | KDM4EADORA2AADORA2BADORA1CYP2C9 | |
| SCHEMBL27992166 | 0.66 | ALDH1A1 (0.48) | ALDH1A1KDM4EL3MBTL1LMNAPOLB | |
| Hydrochloric Acid SCHEMBL8573929 | 0.66 | PDE4D (0.64) | ALDH1A1KDM4EL3MBTL1ADORA2AADORA2B | |
| SCHEMBL2338271 | 0.65 | PDE4A (0.48) | ALDH1A1KDM4EADORA2AADORA2BADORA1 | |
| SCHEMBL28719431 | 0.65 | KDM4E (0.56) | ALDH1A1KDM4ECYP2C9POLBSMN1; SMN2 | |
| SCHEMBL1581159 | 0.64 | PBK (0.49) | ALDH1A1KDM4ELMNAMEN1HPGD | |
| SCHEMBL2332973 | 0.63 | PBK (0.60) | KDM4EADORA2AADORA2BADORA1CYP2C9 | |
| SCHEMBL2331285 | 0.62 | PDE4D (0.45) | ALDH1A1KDM4ELMNAPOLBNPSR1 |
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-2364087-A1 | 7-HYDROXY-BENZOIMIDAZOLE-4-YL-METHANONE DERIVATIVES AND PBK INHIBITORS CONTAINING THE SAME | Oncotherapy Science, Inc. (JP) | 2011-09-14 | — | — | EP | disclosed |
| WO-2010051085-A1 | 7-HYDROXY-BENZOIMIDAZOLE-4-YL-METHANONE DERIVATIVES AND PBK INHIBITORS CONTAINING THE SAME | ONCOTHERAPY SCIENCE, INC. (JP) | 2010-05-06 | — | — | WO | disclosed |