Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.54 |
| ▸ | POLB | P06746 | 3/20 | 0.54 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.51 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.46 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28053185 | 0.80 | SMN1; SMN2 (0.53) | MAPTPOLBNAPRTHSD17B10ALDH1A1 | |
| SCHEMBL8210179 | 0.79 | MAPT (0.51) | MAPTPOLBNAPRTHSD17B10ALDH1A1 | |
| SCHEMBL29628639 | 0.79 | CYP2D6 (0.67) | MAPTHSD17B10ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL9823526 | 0.78 | POLB (0.58) | MAPTPOLBNAPRTHSD17B10ALDH1A1 | |
| SCHEMBL28006502 | 0.76 | CYP2D6 (0.47) | POLBAKR1C3RAB9AKMT2ANPC1 | |
| SCHEMBL27952807 | 0.76 | MAPT (0.61) | MAPTPOLBNAPRTHSD17B10ALDH1A1 | |
| SCHEMBL104524 | 0.75 | SMN1; SMN2 (0.61) | MAPTPOLBNAPRTHSD17B10ALDH1A1 | |
| SCHEMBL10700168 | 0.75 | SMN1; SMN2 (0.52) | MAPTPOLBNAPRTHSD17B10ALDH1A1 | |
| SCHEMBL27843902 | 0.75 | SMN1; SMN2 (0.52) | MAPTPOLBNAPRTHSD17B10ALDH1A1 | |
| SCHEMBL8435555 | 0.74 | MAPT (0.58) | MAPTPOLBNAPRTHSD17B10ALDH1A1 |
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-106432095-B | The preparation of -3 (2H) -one of pimobendan key intermediate 6- (3,4- diamino-phenyl) -5- methyl -4,5- dihydrogen dazin | 东南大学 | 2019-04-16 | — | — | CN | disclosed |
| CN-106432095-A | Preparation of 6-(3,4-diamino phenyl)-5-methyl-4,5-dihydropyridazine-3(2H)-ketone key intermediate of 2-(4-methoxyphenyl)-5(6)-(5-methyl-3-oxo-4,5-dihydro-2H-6-pyridazinyl)benzimidazole | 海门慧聚药业有限公司 | 2017-02-22 | — | — | CN | disclosed |