Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRP | O00591 | 2/20 | 0.38 |
| ▸ | GABRD | O14764 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.38 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.38 |
| ▸ | GABRE | P78334 | 2/20 | 0.38 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.38 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.38 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.38 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8600006 | 0.95 | HTT (0.36) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL28003388 | 0.94 | BID (0.38) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL8568292 | 0.81 | ALDH1A1 (0.39) | HTTPOLBALDH1A1NPC1RAB9A | |
| SCHEMBL27766587 | 0.79 | HTT (0.44) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL27744819 | 0.78 | NPC1 (0.40) | HTTPOLBL3MBTL1ALDH1A1NPC1 | |
| SCHEMBL8565247 | 0.78 | ALDH1A1 (0.41) | HTTPOLBL3MBTL1ALDH1A1TDP1 | |
| SCHEMBL8601222 | 0.77 | MAPT (0.42) | POLBALDH1A1TLR8NPC1RAB9A | |
| SCHEMBL8597579 | 0.76 | HTT (0.40) | HTTPOLBALDH1A1MAPT | |
| SCHEMBL27900729 | 0.75 | TLR8 (0.47) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL8601080 | 0.75 | HTT (0.43) | HTTL3MBTL1ALDH1A1TLR8NPC1 |
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-109641902-A | It can be used as the Triazolopyridine oxazinone derivative of people's PDE1 inhibitor | 伊莱利利公司 | 2019-04-16 | — | — | CN | disclosed |
| CN-108602799-A | A kind of kinase inhibitor | 上海复尚慧创医药研究有限公司 | 2018-09-28 | — | — | CN | disclosed |