Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.32 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.32 |
| ▸ | STAT3 | P40763 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MITF | O75030 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL19006007 | 0.90 | CYP3A4 (0.39) | KCNH2TMEM97SIGMAR1 | |
| SCHEMBL19005997 | 0.90 | SIGMAR1 (0.34) | KCNH2TMEM97SIGMAR1STAT3PDE4D | |
| SCHEMBL19005915 | 0.82 | PDE4A (0.33) | PDE4D | |
| SCHEMBL18987395 | 0.81 | CHRM4 (0.37) | KDM4EMITFALDH1A1HTT | |
| SCHEMBL19005966 | 0.81 | CYP3A4 (0.38) | KCNH2TMEM97SIGMAR1 | |
| SCHEMBL18987234 | 0.79 | PPARG (0.32) | — | |
| SCHEMBL19005987 | 0.76 | HDAC1 (0.38) | KDM4EALDH1A1 | |
| SCHEMBL997271 | 0.72 | TUBB1 (0.48) | PDE4DKDM4EALDH1A1 | |
| SCHEMBL997270 | 0.72 | TUBB1 (0.48) | PDE4DKDM4EALDH1A1 | |
| SCHEMBL19005967 | 0.71 | GAA (0.36) | KDM4EALDH1A1HTT |
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-2017103637-A1 | DIPHENYLPROPANE COMPOUNDS AND THEIR CYTOTOXIC ACTIVITY | BLIRT S.A. (PL) | 2017-06-22 | — | — | WO | disclosed |