Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.43 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SI | P14410 | 1/20 | 0.41 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.41 |
| ▸ | SCD | O00767 | 1/20 | 0.40 |
| ▸ | GUSB | P08236 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 2/20 | 0.38 |
| ▸ | ACP1 | P24666 | 1/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | RAF1 | P04049 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 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 | |
|---|---|---|---|---|
| SCHEMBL28473608 | 0.86 | NPC1 (0.48) | PIN1KDRACP1METKDM4E | |
| SCHEMBL28242995 | 0.86 | MGAM (0.42) | PIN1MGAMGAASIMGAM2 | |
| SCHEMBL8202622 | 0.77 | MEN1 (0.47) | GAAGUSBKDM4ENPC1RAB9A | |
| SCHEMBL28458246 | 0.77 | SCD (0.39) | GAASCDGUSBDHODHKDM4E | |
| SCHEMBL7146757 | 0.76 | NPC1 (0.55) | GAAGUSBKDM4ENPC1RAB9A | |
| SCHEMBL30872095 | 0.74 | NPC1 (0.49) | GAAGUSBKDRKDM4ENPC1 | |
| SCHEMBL230980 | 0.74 | NPC1 (0.49) | GAAGUSBKDRKDM4ENPC1 | |
| SCHEMBL27761849 | 0.74 | NPC1 (0.56) | GAAKDRKDM4ENPC1RAB9A | |
| SCHEMBL6840189 | 0.74 | PIN1 (0.58) | PIN1MGAMGAASIMGAM2 | |
| SCHEMBL28241148 | 0.73 | ALDH1A1 (0.58) | GAAKDM4ENPC1RAB9ASMN1; SMN2 |
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-108586352-B | Organic material and application thereof in organic electroluminescent device | 北京燕化集联光电技术有限公司 | 2020-09-08 | — | — | CN | disclosed |