Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.71 |
| ▸ | HPGD | P15428 | 2/20 | 0.71 |
| ▸ | MEN1 | O00255 | 1/20 | 0.71 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.71 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.71 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.58 |
| ▸ | MAPT | P10636 | 8/20 | 0.57 |
| ▸ | MAOB | P27338 | 4/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28090599 | 0.90 | MAPT (0.58) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL28090832 | 0.90 | ALDH1A1 (0.57) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL28090837 | 0.90 | ALDH1A1 (0.57) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL28090870 | 0.87 | KDM4E (0.55) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL28090518 | 0.86 | MAPT (0.54) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL28090875 | 0.86 | ALDH1A1 (0.69) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL1759145 | 0.84 | KDM4E (0.77) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL17277745 | 0.81 | KDM4E (0.73) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL28090534 | 0.80 | ADORA2A (0.63) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL28090833 | 0.78 | ADORA2A (0.45) | KDM4EALDH1A1HPGDMEN1KMT2A |
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-108640922-B | Triazole and diazepine -5- ketone compounds | 沈阳药科大学 | 2019-08-30 | — | — | CN | disclosed |
| CN-108640922-A | Triazole and diazepine -5- ketone compounds | 沈阳药科大学 | 2018-10-12 | — | — | CN | disclosed |
| CN-106187923-A | 2 aryl 4 aroyl triazole compounds and application thereof | 沈阳药科大学 | 2016-12-07 | — | — | CN | disclosed |