Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA7 | P43166 | 3/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | CDC7 | O00311 | 2/20 | 0.39 |
| ▸ | DBF4 | Q9UBU7 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL21843252 | 0.78 | BRD4 (0.56) | BRD4ALDH1A1CYP1A2PDE4AMAPT | |
| SCHEMBL9099771 | 0.77 | CA12 (0.40) | BRD4CYP1A2KDM4ECA12CA1 | |
| SCHEMBL26081236 | 0.73 | BRD4 (0.51) | BRD4ALDH1A1CYP1A2PDE4AMAPT | |
| SCHEMBL750492 | 0.73 | BRD4 (0.51) | BRD4ALDH1A1CYP1A2PDE4AMAPT | |
| SCHEMBL8924724 | 0.72 | KDM4E (0.41) | ALDH1A1CYP1A2MAPTKDM4EALOX15 | |
| SCHEMBL159285 | 0.72 | BRD4 (0.50) | BRD4ALDH1A1CYP1A2PDE4AMAPT | |
| SCHEMBL14398367 | 0.72 | KDM4E (0.60) | BRD4ALDH1A1CYP1A2PDE4AMAPT | |
| SCHEMBL29396522 | 0.71 | BRD4 (0.61) | BRD4ALDH1A1CYP1A2PDE4AMAPT | |
| SCHEMBL1240286 | 0.71 | BRD4 (0.61) | BRD4ALDH1A1CYP1A2PDE4AMAPT | |
| SCHEMBL10002474 | 0.71 | ADORA3 (0.32) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5639770-A | SUPEROXIDE INHIBITOR | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1997-06-17 | — | — | US | disclosed |
| EP-0600092-A1 | THIAZOLE DERIVATIVE | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-06-08 | — | — | EP | disclosed |