Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD | O00767 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TNKS | O95271 | 3/20 | 0.38 |
| ▸ | TNKS2 | Q9H2K2 | 3/20 | 0.38 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.38 |
| ▸ | FADS1 | O60427 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | DHODH | Q02127 | 3/20 | 0.37 |
| ▸ | PARP1 | P09874 | 2/20 | 0.37 |
| ▸ | GUSB | P08236 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28458383 | 0.87 | NPC1 (0.40) | NPC1RAB9AGAAKDM4ESMN1; SMN2 | |
| SCHEMBL7146757 | 0.79 | NPC1 (0.55) | NPC1RAB9AGAAKDM4ESMN1; SMN2 | |
| SCHEMBL27761849 | 0.77 | NPC1 (0.56) | NPC1RAB9AGAAKDM4ESMN1; SMN2 | |
| SCHEMBL28468751 | 0.77 | PIN1 (0.43) | SCDNPC1RAB9AGAAKDM4E | |
| Water SCHEMBL28237887 | 0.76 | NPC1 (0.55) | NPC1RAB9AGAAKDM4ESMN1; SMN2 | |
| SCHEMBL28136411 | 0.75 | TNKS (0.56) | NPC1RAB9AGAAKDM4ESMN1; SMN2 | |
| SCHEMBL230980 | 0.74 | NPC1 (0.49) | NPC1RAB9AGAAKDM4ESMN1; SMN2 | |
| SCHEMBL30872095 | 0.74 | NPC1 (0.49) | NPC1RAB9AGAAKDM4ESMN1; SMN2 | |
| SCHEMBL8202622 | 0.74 | MEN1 (0.47) | NPC1RAB9AGAAKDM4ESMN1; SMN2 | |
| SCHEMBL28473608 | 0.73 | NPC1 (0.48) | NPC1RAB9AKDM4ESMN1; SMN2ALDH1A1 |
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-108129394-B | Organic electroluminescent material and preparation method and application thereof | 北京燕化集联光电技术有限公司 | 2020-09-15 | — | — | CN | disclosed |