Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | DCPS | Q96C86 | 1/20 | 0.53 |
| ▸ | TLR8 | Q9NR97 | 8/20 | 0.50 |
| ▸ | TLR7 | Q9NYK1 | 4/20 | 0.50 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.47 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 3/20 | 0.46 |
| ▸ | ELANE | P08246 | 1/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.45 |
| ▸ | PRNP | P04156 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL1458588 | 0.88 | TLR8 (0.57) | DCPSTLR8TLR7 | |
| SCHEMBL22498767 | 0.87 | TLR8 (0.58) | KDM4EALDH1A1GAAHPGDDCPS | |
| SCHEMBL29377718 | 0.87 | TLR8 (0.58) | KDM4EALDH1A1GAAHPGDDCPS | |
| SCHEMBL28203089 | 0.87 | TLR8 (0.58) | KDM4EALDH1A1GAAHPGDDCPS | |
| SCHEMBL29109414 | 0.85 | DCPS (0.57) | KDM4EALDH1A1GAAHPGDDCPS | |
| SCHEMBL17904025 | 0.80 | ALDH1A1 (0.56) | KDM4EALDH1A1GAAHPGDMAPK1 | |
| SCHEMBL28508187 | 0.80 | TLR8 (0.48) | KDM4EALDH1A1GAAHPGDTLR8 | |
| SCHEMBL28504818 | 0.80 | TLR8 (0.51) | KDM4EALDH1A1GAAHPGDTLR8 | |
| SCHEMBL10548915 | 0.79 | ALDH1A1 (0.55) | KDM4EALDH1A1GAAHPGDTLR8 | |
| SCHEMBL9173175 | 0.79 | ALDH1A1 (0.55) | KDM4EALDH1A1GAAHPGDMAPK1 |
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-108250142-A | Amine compounds having anti-inflammatory, antifungal, antiparasitic and anticancer activity | 维尔斯达医疗公司 | 2018-07-06 | — | — | CN | disclosed |