Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.51 |
| ▸ | GRK6 | P43250 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | TDO2 | P48775 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28075558 | 0.86 | DCUN1D1 (0.51) | DCUN1D1IDO1TDO2NPC1RAB9A | |
| SCHEMBL28095608 | 0.86 | DCUN1D1 (0.51) | DCUN1D1IDO1TDO2NPC1RAB9A | |
| SCHEMBL28075557 | 0.82 | GRK6 (0.52) | DCUN1D1GRK6NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28096083 | 0.79 | MAPT (0.49) | DCUN1D1SMN1; SMN2KDM4EHSD17B10TP53 | |
| SCHEMBL17280056 | 0.79 | DCUN1D1 (0.62) | DCUN1D1NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL28096010 | 0.78 | KDM4E (0.55) | GRK6KDM4EHSD17B10POLBTSHR | |
| SCHEMBL18927318 | 0.76 | SMN1; SMN2 (0.56) | IDO1TDO2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28833481 | 0.74 | AMY1A (0.46) | GRK6NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL23388700 | 0.73 | DCUN1D1 (0.54) | DCUN1D1NPC1RAB9ASMN1; SMN2KDM4E | |
| SCHEMBL15436211 | 0.71 | KIT (0.58) | DCUN1D1IDO1TDO2NPC1RAB9A |
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-106243130-B | 3,6- diaryl-[1,2,4] triazole simultaneously [3,4-b] [1,3,4] diazthines compound and application thereof | 沈阳药科大学 | 2019-03-01 | — | — | CN | claimed |
| CN-106243130-A | 3,6 diaryl [1,2,4] triazole also [3,4 b] [1,3,4] diazthines compound and application thereof | 沈阳药科大学 | 2016-12-21 | — | — | CN | claimed |
| CN-106243130-A | 3,6 diaryl [1,2,4] triazole also [3,4 b] [1,3,4] diazthines compound and application thereof | 沈阳药科大学 | 2016-12-21 | — | — | CN | disclosed |