Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPR | P35270 | 1/20 | 0.45 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | RET | P07949 | 1/20 | 0.39 |
| ▸ | KIF18A | Q8NI77 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.36 |
| ▸ | PRKDC | P78527 | 2/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.35 |
| ▸ | GBA1 | P04062 | 2/20 | 0.34 |
| ▸ | JAK3 | P52333 | 3/20 | 0.33 |
| ▸ | BTK | Q06187 | 2/20 | 0.33 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17667274 | 0.98 | SPR (0.43) | SPRPDE10ARETKIF18AHSD11B1 | |
| SCHEMBL17628272 | 0.93 | SPR (0.46) | SPRPDE10ARETKIF18AHSD11B1 | |
| SCHEMBL17628270 | 0.93 | SPR (0.46) | SPRPDE10ARETKIF18AHSD11B1 | |
| SCHEMBL17628075 | 0.86 | PRKDC (0.39) | SPRPRKDCHRH4GBA1JAK3 | |
| SCHEMBL17627935 | 0.83 | PRKDC (0.39) | PRKDCHRH4GBA1JAK3BTK | |
| SCHEMBL17667365 | 0.81 | HRH4 (0.36) | PRKDCHRH4GBA1LMNATSHR | |
| SCHEMBL17667367 | 0.81 | HRH4 (0.36) | PRKDCHRH4GBA1LMNATSHR | |
| SCHEMBL17628208 | 0.81 | CFTR (0.42) | SPRPDE10AHSD11B1AAK1HRH4 | |
| SCHEMBL17628211 | 0.81 | CFTR (0.42) | SPRPDE10AHSD11B1AAK1HRH4 | |
| SCHEMBL17628349 | 0.80 | HRH4 (0.41) | SPRPRKDCHRH4JAK3JAK2 |
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-3006439-A1 | BICYCLIC DERIVATIVE CONTAINING PYRIMIDINE RING, AND PREPARATION METHOD THEREFOR | Yuhan Corporation (KR) | 2016-04-13 | — | — | EP | disclosed |