Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.47 |
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10703055 | 0.86 | MAOA (0.59) | MAOACES1BCHEALDH1A1NPC1 | |
| SCHEMBL11426388 | 0.85 | MAOA (0.50) | MAOACES1BCHEALDH1A1NPC1 | |
| SCHEMBL10447390 | 0.85 | MAOA (0.57) | MAOACES1BCHEALDH1A1CYP2D6 | |
| SCHEMBL11481878 | 0.82 | MAOA (0.50) | MAOACES1BCHEALDH1A1NPC1 | |
| SCHEMBL8205266 | 0.79 | ALDH1A1 (0.53) | MAOACES1BCHEALDH1A1MEN1 | |
| Acetic Acid SCHEMBL28391444 | 0.78 | MAOA (0.49) | MAOACES1BCHEALDH1A1NPC1 | |
| SCHEMBL17715427 | 0.77 | MAOA (0.55) | MAOACES1BCHEALDH1A1MEN1 | |
| SCHEMBL28296942 | 0.77 | MAOA (0.50) | MAOACES1BCHEALDH1A1NPC1 | |
| SCHEMBL21694426 | 0.76 | DRD2 (0.48) | MAOACES1BCHEALDH1A1CYP2D6 | |
| SCHEMBL11025000 | 0.75 | MAOA (0.49) | MAOACES1BCHEALDH1A1MEN1 |
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-4296043-A | Process for the preparation of benzanthrones | BAYER AKTIENGESELLSCHAFT (DE) | 1981-10-20 | — | — | US | disclosed |