Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.36 |
| ▸ | NNMT | P40261 | 1/20 | 0.36 |
| ▸ | MET | P08581 | 1/20 | 0.36 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 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 | |
|---|---|---|---|---|
| SCHEMBL18756583 | 0.85 | ALDH1A1 (0.46) | SMN1; SMN2MEN1KMT2AKDM4EMAPT | |
| SCHEMBL18756165 | 0.81 | ADORA2A (0.45) | — | |
| SCHEMBL18756053 | 0.79 | RAB9A (0.38) | KMT2A | |
| SCHEMBL18756162 | 0.78 | CHRM1 (0.58) | KCNH2 | |
| SCHEMBL18756164 | 0.78 | KCNH2 (0.42) | GRM2SMN1; SMN2CYP2C9ACACBPIK3CA | |
| SCHEMBL18725359 | 0.77 | KMT2A (0.47) | SMN1; SMN2MEN1KMT2AKDM4EMAPT | |
| SCHEMBL21235161 | 0.76 | KCNH2 (0.41) | GRM2SMN1; SMN2ACACBPIK3CAKCNH2 | |
| SCHEMBL18725367 | 0.76 | CHRM1 (0.51) | — | |
| SCHEMBL21235431 | 0.74 | CHRM1 (0.36) | GRM2SMN1; SMN2PIK3CAKCNH2 | |
| SCHEMBL18756686 | 0.74 | IDH1 (0.40) | GRM2SMN1; SMN2MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3156397-B1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2019-08-07 | — | — | EP | disclosed |
| EP-3156397-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2017-04-19 | — | — | EP | disclosed |