Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CTSD | P07339 | 3/20 | 0.35 |
| ▸ | GUSB | P08236 | 1/20 | 0.35 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | BRD4 | O60885 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | RPS6KA5 | O75582 | 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 | |
|---|---|---|---|---|
| SCHEMBL11720098 | 0.80 | KCNK13 (0.35) | L3MBTL1KDM4EHPGDCTSDGUSB | |
| SCHEMBL11725530 | 0.77 | ALDH1A1 (0.39) | IRAK4L3MBTL1KDM4EHPGDCTSD | |
| SCHEMBL11724276 | 0.76 | BRD4 (0.40) | IRAK4KDM4EHPGDALDH1A1MAPK1 | |
| SCHEMBL11725545 | 0.73 | CXCR3 (0.43) | IRAK4KDM4EHPGDCXCR3ALDH1A1 | |
| SCHEMBL11725524 | 0.69 | ALDH1A1 (0.47) | IRAK4L3MBTL1CTSDGUSBCXCR3 | |
| SCHEMBL11725390 | 0.69 | ALDH1A1 (0.52) | IRAK4L3MBTL1KDM4EHPGDCTSD | |
| SCHEMBL9780825 | 0.67 | ALDH1A1 (0.40) | KDM4EALDH1A1MAPK1LMNATHRB | |
| SCHEMBL11720091 | 0.67 | ALDH1A1 (0.36) | L3MBTL1KDM4EHPGDCTSDGUSB | |
| SCHEMBL27154650 | 0.66 | KDM4E (0.61) | KDM4EHPGDALDH1A1LMNATSHR | |
| SCHEMBL6387107 | 0.65 | HPGD (0.66) | KDM4EHPGDALDH1A1LMNATSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4053472-A | MICROBIOCIDES | SCHERING AKTIENGESELLSCHAFT (DT) | 1977-10-11 | — | — | US | disclosed |