Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 4/20 | 0.36 |
| ▸ | DDO | Q99489 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 2/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 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 | |
|---|---|---|---|---|
| SCHEMBL7005666 | 0.81 | DAO (0.41) | BRD4ALDH1A1NPC1RAB9ADAO | |
| SCHEMBL7005550 | 0.80 | CHEK1 (0.45) | BRD4ALDH1A1KDM4EDAOCYP1A2 | |
| SCHEMBL7006748 | 0.80 | BRD4 (0.45) | BRD4CYP2A6CDK5CHEK1PIM1 | |
| SCHEMBL7010349 | 0.78 | BRD4 (0.43) | BRD4DAO | |
| SCHEMBL4751214 | 0.77 | PARP1 (0.41) | BRD4ALDH1A1KDM4EDAOMAPT | |
| SCHEMBL7006207 | 0.75 | GRIA1 (0.41) | DAOCA12CA9CYP1A2MAPT | |
| SCHEMBL7005436 | 0.73 | MAPT (0.38) | BRD4ALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL7007056 | 0.73 | CES1 (0.38) | KDM4EDAO | |
| SCHEMBL7003213 | 0.69 | NSD2 (0.50) | NPC1RAB9ACA12CA9CHEK1 | |
| SCHEMBL12241445 | 0.68 | TNKS (0.39) | BRD4DAOPARP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1200439-B1 | 1,2-DIHYDRO-1-OXO-PARAZINO(1,2-A) INDOLE DERIVATIVES | NOVUSPHARMA SPA (IT) | 2003-06-25 | — | — | EP | disclosed |