Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29427945 | 0.80 | SRC (0.58) | NPC1RAB9AHDAC1HDAC6CA12 | |
| SCHEMBL25256710 | 0.80 | SRC (0.58) | NPC1RAB9AHDAC1HDAC6CA12 | |
| SCHEMBL28336686 | 0.80 | NPC1 (0.46) | NPC1RAB9AHDAC1HDAC6CA12 | |
| SCHEMBL28049339 | 0.80 | CYP1A2 (0.53) | NPC1RAB9APARP1ALDH1A1LMNA | |
| SCHEMBL28074474 | 0.77 | NPC1 (0.47) | NPC1RAB9AHDAC1HDAC6CA12 | |
| SCHEMBL28200751 | 0.75 | MEN1 (0.50) | CA12MMP2CA9KDM4EALDH1A1 | |
| SCHEMBL27637358 | 0.75 | NPC1 (0.42) | NPC1RAB9AHDAC1HDAC6CA12 | |
| SCHEMBL28338564 | 0.75 | NPC1 (0.42) | NPC1RAB9AHDAC1HDAC6CA12 | |
| SCHEMBL28200127 | 0.74 | INPPL1 (0.37) | RAB9ACA12MMP2CA9CA14 | |
| SCHEMBL27850879 | 0.73 | LMNA (0.42) | NPC1RAB9AHDAC1HDAC6CA12 |
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-107663161-A | A kind of continuous stream synthesis technique of phenylhydrazine salt and substituted benzene hydrazonium salt | 上海惠和化德生物科技有限公司 | 2018-02-06 | — | — | CN | disclosed |