Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | RAF1 | P04049 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL1663030 | 0.81 | ALDH1A1 (0.47) | ALDH1A1MAPK1MEN1KMT2AMAPT | |
| SCHEMBL1663051 | 0.80 | POLB (0.49) | ALDH1A1LMNAMAPTHPGDNPC1 | |
| SCHEMBL9108332 | 0.79 | ALDH1A1 (0.43) | ALDH1A1MAPK1MEN1KMT2ALMNA | |
| SCHEMBL28264690 | 0.77 | ALDH1A1 (0.44) | ALDH1A1MAPK1KMT2AMAPTHPGD | |
| SCHEMBL2770853 | 0.77 | ATM (0.49) | ALDH1A1MEN1KMT2ALMNAMAPT | |
| SCHEMBL9107612 | 0.72 | ALDH1A1 (0.63) | ALDH1A1MEN1KMT2AMAPTKDM4E | |
| SCHEMBL9112833 | 0.72 | GAA (0.49) | ALDH1A1MAPK1MEN1KMT2ALMNA | |
| Methyl Alcohol SCHEMBL28009562 | 0.71 | ALDH1A1 (0.49) | ALDH1A1MAPK1MEN1KMT2ALMNA | |
| SCHEMBL22065392 | 0.71 | ALDH1A1 (0.52) | ALDH1A1MAPK1MEN1KMT2ALMNA | |
| SCHEMBL17403321 | 0.70 | TSHR (0.47) | MEN1KMT2ALMNAMAPTHPGD |
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-109134599-A | Pyrrolobenzodiazepines Zhuo and its conjugate | 麦迪穆有限责任公司 | 2019-01-04 | — | — | CN | disclosed |