Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.45 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | MERTK | Q12866 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27657684 | 0.89 | EGFR (0.46) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| Hydroquinone SCHEMBL11475895 | 0.85 | EGFR (0.44) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL4847049 | 0.83 | GPR35 (0.58) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL11475898 | 0.82 | MERTK (0.48) | ALDH1A1HPGDMAPTKDM4ECYP1A2 | |
| SCHEMBL11481976 | 0.80 | VCAM1 (0.62) | ALDH1A1HPGDMAPTCYP1A2POLB | |
| SCHEMBL4839671 | 0.80 | GPR35 (0.55) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL27657688 | 0.79 | F10 (0.42) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL16628146 | 0.79 | HSPB1 (0.53) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL4840927 | 0.79 | GPR35 (0.53) | ALDH1A1HPGDMAPTKDM4ELMNA | |
| SCHEMBL1980405 | 0.78 | MEN1 (0.52) | ALDH1A1MAPTKDM4EPOLBVCAM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100443464-C | AB type dibasic aminoacid monomer containing hydroxy group and its preparation method | UNIV SICHUAN (CN) | 2008-12-17 | — | — | CN | disclosed |
| CN-1865225-A | AB type dibasic aminoacid monomer containing hydroxy group and its preparation method | UNIV SICHUAN (CN) | 2006-11-22 | — | — | CN | disclosed |