Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.44 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.44 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.44 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.44 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30572460 | 0.90 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1NPC1CYP1A2RAB9A | |
| SCHEMBL28601041 | 0.87 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1NPC1CYP1A2RAB9A | |
| SCHEMBL29799053 | 0.87 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1NPC1CYP1A2RAB9A | |
| SCHEMBL13295307 | 0.87 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1NPC1CYP1A2RAB9A | |
| SCHEMBL16651263 | 0.85 | PLA2G2A (0.43) | ALDH1A1L3MBTL1NPC1RAB9AKDM4E | |
| SCHEMBL1061700 | 0.85 | TSHR (0.51) | ALDH1A1L3MBTL1NPC1CYP1A2RAB9A | |
| SCHEMBL30573065 | 0.85 | TSHR (0.51) | ALDH1A1L3MBTL1NPC1CYP1A2RAB9A | |
| SCHEMBL6525162 | 0.85 | ALDH1A1 (0.58) | ALDH1A1L3MBTL1NPC1CYP1A2RAB9A | |
| SCHEMBL29799182 | 0.84 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1NPC1CYP1A2RAB9A | |
| SCHEMBL28601043 | 0.84 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1NPC1CYP1A2RAB9A |
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 3 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 |
| US-7732146-B2 | Method for screening an agent that modulates activity of macrophage migration inhibitory factor | AVANIR PHARMACEUTICALS (US) | 2010-06-08 | — | — | US | disclosed |