Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.45 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.43 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.41 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.38 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.38 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 2/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.38 |
| ▸ | CDC7 | O00311 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28468751 | 0.86 | PIN1 (0.43) | NPC1RAB9APIN1KDM4ESMN1; SMN2 | |
| SCHEMBL28458383 | 0.77 | NPC1 (0.40) | NPC1RAB9AKDM4EALDH1A1MAPT | |
| SCHEMBL8202622 | 0.76 | MEN1 (0.47) | NPC1RAB9APBRM1KDM4EALDH1A1 | |
| SCHEMBL7146757 | 0.75 | NPC1 (0.55) | NPC1RAB9AKDM4EALDH1A1TP53 | |
| SCHEMBL8628371 | 0.73 | NPC1 (0.44) | NPC1RAB9APBRM1NPBWR1KDM4E | |
| SCHEMBL230980 | 0.73 | NPC1 (0.49) | NPC1RAB9AKDM4EALDH1A1TP53 | |
| SCHEMBL30872095 | 0.73 | NPC1 (0.49) | NPC1RAB9AKDM4EALDH1A1TP53 | |
| SCHEMBL28458246 | 0.73 | SCD (0.39) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL27761849 | 0.73 | NPC1 (0.56) | NPC1RAB9AKDM4EALDH1A1TP53 | |
| SCHEMBL2700407 | 0.73 | MGLL (0.59) | MAPT |
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-108165260-B | Organic electroluminescent material and preparation method and application thereof | 北京燕化集联光电技术有限公司 | 2020-10-09 | — | — | CN | disclosed |