Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | PRKDC | P78527 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 6/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.35 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | TRIM33 | Q9UPN9 | 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 | |
|---|---|---|---|---|
| SCHEMBL1663030 | 0.81 | ALDH1A1 (0.47) | ALDH1A1MAPTCYP3A4HSD17B10HTT | |
| SCHEMBL9108332 | 0.79 | ALDH1A1 (0.43) | ALDH1A1MAPTKDM4EALOX15HTT | |
| SCHEMBL1572278 | 0.79 | ALDH1A1 (0.60) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL22974979 | 0.77 | ALDH1A1 (0.50) | ALDH1A1KDM4EKMT2ATDP1ERN1 | |
| SCHEMBL5379601 | 0.77 | ALDH1A1 (0.39) | ALDH1A1MAPTKDM4ECYP3A4KMT2A | |
| SCHEMBL28264689 | 0.77 | ALDH1A1 (0.39) | ALDH1A1MAPTKDM4ECYP3A4HTT | |
| SCHEMBL2770853 | 0.77 | ATM (0.49) | ALDH1A1MAPTCYP3A4HTTKMT2A | |
| SCHEMBL29524066 | 0.75 | ALDH1A1 (0.73) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL15666012 | 0.75 | ALDH1A1 (0.73) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 | |
| SCHEMBL260331 | 0.75 | ALDH1A1 (0.47) | ALDH1A1MAPTKDM4ECYP3A4ALOX15 |
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 |