Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY12 | Q9H244 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CCR6 | P51684 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17261493 | 1.00 | P2RY12 (0.43) | P2RY12MAPTPKMRAB9AHSD17B10 | |
| SCHEMBL17261474 | 1.00 | P2RY12 (0.43) | P2RY12MAPTPKMRAB9AHSD17B10 | |
| SCHEMBL29302285 | 0.85 | KDM4E (0.52) | MAPTPKMHSD17B10MEN1KMT2A | |
| SCHEMBL24618493 | 0.82 | KDM4E (0.40) | MAPTPKMKDM4EALDH1A1CYP1A2 | |
| SCHEMBL20592220 | 0.82 | KDM4E (0.40) | MAPTPKMKMT2AKDM4EALDH1A1 | |
| SCHEMBL18989813 | 0.82 | KDM4E (0.43) | MAPTPKMRAB9AHSD17B10KDM4E | |
| SCHEMBL19013571 | 0.82 | KDM4E (0.40) | MAPTPKMKMT2AKDM4EALDH1A1 | |
| SCHEMBL18989655 | 0.82 | KDM4E (0.40) | MAPTPKMKMT2AKDM4EALDH1A1 | |
| SCHEMBL19013302 | 0.82 | KDM4E (0.43) | MAPTPKMRAB9AHSD17B10KDM4E | |
| SCHEMBL18989669 | 0.82 | KDM4E (0.43) | MAPTPKMRAB9AHSD17B10KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015172196-A1 | HETEROCYCLIC COMPOUNDS AND USE OF SAME | MONASH UNIVERSITY (AU) | 2015-11-19 | — | — | WO | disclosed |