Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.45 |
| ▸ | MET | P08581 | 5/20 | 0.44 |
| ▸ | CHKA | P35790 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28028731 | 0.87 | ALDH1A1 (0.46) | DAONPC1POLBRAB9AALDH1A1 | |
| SCHEMBL2107923 | 0.78 | NPC1 (0.57) | DAONPC1POLBRAB9AALDH1A1 | |
| SCHEMBL6644343 | 0.75 | CYP1A2 (0.50) | DAOMAPTMEN1KMT2A | |
| SCHEMBL28167297 | 0.75 | PDGFRB (0.43) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL6961498 | 0.75 | DAO (0.57) | DAONPC1POLBRAB9AALDH1A1 | |
| SCHEMBL359532 | 0.75 | NPC1 (0.53) | DAONPC1POLBRAB9AALDH1A1 | |
| SCHEMBL366012 | 0.75 | ALDH1A1 (0.62) | NPC1POLBRAB9AALDH1A1MAPT | |
| SCHEMBL507149 | 0.74 | ALDH1A1 (0.58) | DAONPC1POLBRAB9AALDH1A1 | |
| SCHEMBL4075213 | 0.74 | NPC1 (0.57) | DAONPC1POLBRAB9AALDH1A1 | |
| SCHEMBL21169605 | 0.74 | NPC1 (0.57) | DAONPC1POLBRAB9AALDH1A1 |
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-104860880-A | Method for synthesizing 8-(nitro methyl) quinoline compounds | UNIV ZHEJIANG TECHNOLOGY | 2015-08-26 | — | — | CN | disclosed |