Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CSF1R | P07333 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.45 |
| ▸ | XBP1 | P17861 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29799053 | 0.89 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1KDM4EHPGDCYP1A2 | |
| SCHEMBL13295307 | 0.89 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1KDM4EHPGDCYP1A2 | |
| SCHEMBL13312804 | 0.87 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1KDM4EHPGDCYP1A2 | |
| SCHEMBL1061700 | 0.87 | TSHR (0.51) | ALDH1A1L3MBTL1KDM4EHPGDTSHR | |
| SCHEMBL6525162 | 0.87 | ALDH1A1 (0.58) | ALDH1A1L3MBTL1KDM4ECYP1A2CYP2C19 | |
| SCHEMBL30573065 | 0.87 | TSHR (0.51) | ALDH1A1L3MBTL1KDM4EHPGDTSHR | |
| SCHEMBL29799068 | 0.86 | KDM4E (0.59) | ALDH1A1L3MBTL1KDM4EHPGDTSHR | |
| SCHEMBL1063212 | 0.86 | KDM4E (0.59) | ALDH1A1L3MBTL1KDM4EHPGDTSHR | |
| SCHEMBL28601043 | 0.86 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 | |
| SCHEMBL29799182 | 0.86 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1KDM4EHPGDHSD17B10 |
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-113121435-B | Synthetic method of 2, 4-dichloroquinoline compound | 辽宁大学 | 2022-08-30 | — | — | CN | disclosed |
| CN-113121435-A | Synthetic method of 2, 4-dichloroquinoline compound | 辽宁大学 | 2021-07-16 | — | — | CN | disclosed |