Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | TGM2 | P21980 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | DHPS | P49366 | 1/20 | 0.42 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 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 | |
|---|---|---|---|---|
| SCHEMBL27638475 | 0.79 | HDAC8 (0.38) | ALDH1A1L3MBTL1SMN1; SMN2KDM4ENPC1 | |
| SCHEMBL28080836 | 0.78 | F2RL3 (0.39) | ADRA1DALDH1A1 | |
| SCHEMBL28080903 | 0.74 | ALDH1A1 (0.43) | ADRA1DALDH1A1SMN1; SMN2KDM4ECNR2 | |
| SCHEMBL28080894 | 0.73 | ALDH1A1 (0.47) | ADRA1DALDH1A1L3MBTL1SMN1; SMN2KDM4E | |
| SCHEMBL28080828 | 0.73 | CCR2 (0.46) | CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL28080891 | 0.71 | ALDH1A1 (0.44) | ADRA1DALDH1A1L3MBTL1SMN1; SMN2CYP3A4 | |
| SCHEMBL28080843 | 0.68 | CYP11B1 (0.44) | ALDH1A1KDM4EHDAC8HDAC6 | |
| SCHEMBL27962502 | 0.68 | HDAC4 (0.37) | CYP2D6CYP2C9CYP2C19NPC1HDAC3 | |
| SCHEMBL27633488 | 0.68 | DHPS (0.50) | ADRA1DALDH1A1L3MBTL1DHPSCYP2E1 | |
| SCHEMBL27934873 | 0.67 | HPGD (0.46) | ALDH1A1L3MBTL1SMN1; SMN2CYP2D6KDM4E |
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-1823061-A | Pyrrole-2, 5-dione derivatives as liver X receptor modulators | ASTRAZENECA AB (SE) | 2006-08-23 | — | — | CN | disclosed |