Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.37 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.37 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL28460813 | 0.98 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2L3MBTL1HPGDCHRNB2 | |
| Tributylmethylammonium SCHEMBL28955744 | 0.86 | DNM1 (0.46) | ALDH1A1SMN1; SMN2L3MBTL1HPGDCHRNB2 | |
| SCHEMBL7549490 | 0.84 | DNM1 (0.36) | ALDH1A1SMN1; SMN2CHRNB2CHRNB4CHRNA3 | |
| Tributylmethylammonium SCHEMBL28463343 | 0.84 | SMN1; SMN2 (0.47) | ALDH1A1SMN1; SMN2L3MBTL1HPGDCHRNB2 | |
| Benzene SCHEMBL27744734 | 0.81 | SLC22A1 (0.39) | SMN1; SMN2DNM1MEN1KMT2ATP53 | |
| Benzene SCHEMBL27744740 | 0.81 | SLC22A1 (0.39) | ALDH1A1SMN1; SMN2DNM1MEN1KMT2A | |
| Biphenyl SCHEMBL967556 | 0.78 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2L3MBTL1HPGDMAPT | |
| SCHEMBL19244146 | 0.76 | DNM1 (0.55) | ALDH1A1SMN1; SMN2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL5944712 | 0.76 | DNM1 (0.55) | ALDH1A1SMN1; SMN2CHRNB4CHRNA3CHRNA7 | |
| Styrene SCHEMBL28189765 | 0.76 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2HPGDCHRNB2CHRNB4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111732587-B | Abamebactam intermediate compound gemini quaternary ammonium disulfonate and preparation method thereof | 北京耀诚惠仁科技有限公司 | 2022-11-25 | — | — | CN | claimed |