Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TAF1 | P21675 | 1/20 | 0.36 |
| ▸ | CECR2 | Q9BXF3 | 1/20 | 0.36 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20887028 | 0.65 | KDM4E (0.46) | USP2SMN1; SMN2KMT2AKDM4EALDH1A1 | |
| SCHEMBL8276651 | 0.64 | ALDH1A1 (0.50) | USP2SMN1; SMN2KMT2AKDM4EALDH1A1 | |
| SCHEMBL15938381 | 0.63 | GBA1 (0.49) | GBA1 | |
| SCHEMBL27875715 | 0.63 | HTR3A (0.53) | KMT2AHRH4 | |
| SCHEMBL6654686 | 0.63 | HCRTR1 (0.58) | KMT2AKDM4EALDH1A1CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL6657608 | 0.62 | HCRTR1 (0.57) | KMT2AKDM4EALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL2165965 | 0.62 | HRH4 (0.66) | HRH4 | |
| Hypochlorous Acid SCHEMBL6657614 | 0.61 | HCRTR1 (0.56) | KMT2AKDM4EALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL5742714 | 0.61 | MAPT (0.52) | SMN1; SMN2KDM4EALDH1A1HSD17B10HRH4 | |
| SCHEMBL27892359 | 0.61 | CRHBP (0.50) | SMN1; SMN2KMT2AKDM4EALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3287454-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2018-02-28 | — | — | EP | disclosed |