Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.53 |
| ▸ | CES1 | P23141 | 2/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | MAP3K9 | P80192 | 3/20 | 0.41 |
| ▸ | MAP3K11 | Q16584 | 3/20 | 0.41 |
| ▸ | MIF | P14174 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL260885 | 0.87 | MAOA (0.55) | MAOACES1BCHEALDH1A1CYP1A2 | |
| SCHEMBL1985142 | 0.81 | MAOA (0.48) | MAOACES1BCHEALDH1A1CYP1A2 | |
| SCHEMBL9811799 | 0.81 | MAOA (0.48) | MAOACES1BCHEALDH1A1CYP1A2 | |
| SCHEMBL9356907 | 0.78 | CES1 (0.46) | MAOACES1BCHEALDH1A1CYP1A2 | |
| SCHEMBL20669049 | 0.77 | BCHE (0.41) | MAOACES1BCHEALDH1A1CYP1A2 | |
| SCHEMBL5850565 | 0.76 | MEN1 (0.58) | MAOACES1BCHEALDH1A1CYP1A2 | |
| SCHEMBL10703055 | 0.75 | MAOA (0.59) | MAOACES1BCHEALDH1A1CYP1A2 | |
| SCHEMBL11145048 | 0.74 | MAOA (0.44) | MAOACES1BCHEALDH1A1CYP1A2 | |
| SCHEMBL11505033 | 0.74 | MAOA (0.44) | MAOACES1BCHEALDH1A1CYP1A2 | |
| Anthraquinone SCHEMBL22026730 | 0.74 | MAOA (0.95) | MAOACES1BCHEALDH1A1CYP1A2 |
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-4539230-A | COATING WALLS WITH A CHELATE COMPOUND | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1985-09-03 | — | — | US | disclosed |
| EP-0126991-A1 | A method for preventing deposition of polymer scale and a coating agent therefor | Shin-Etsu Chemical Co., Ltd. (JP) | 1984-12-05 | — | — | EP | disclosed |