Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ESRRG | P62508 | 8/20 | 0.38 |
| ▸ | ESRRB | O95718 | 5/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | MRE11 | P49959 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28053400 | 0.83 | ESRRG (0.38) | TP53TSHRESRRGESRRBESR1 | |
| SCHEMBL8590396 | 0.79 | ESR1 (0.41) | ESR1ESR2 | |
| SCHEMBL27886552 | 0.74 | NPC1 (0.46) | ESR1ESR2 | |
| SCHEMBL105433 | 0.70 | KIF11 (0.47) | TP53TSHRESR1ESR2EPHX2 | |
| SCHEMBL10404684 | 0.68 | TYR (0.42) | — | |
| SCHEMBL15125629 | 0.66 | KIF11 (0.57) | TP53TSHRESR1ESR2EPHX2 | |
| SCHEMBL28116428 | 0.65 | KEAP1 (0.41) | TSHRESR1ESR2 | |
| SCHEMBL19806867 | 0.64 | TYR (0.50) | TSHRESRRGESR1ESR2 | |
| SCHEMBL27619569 | 0.64 | ESR1 (0.40) | TP53TSHRESR1ESR2 | |
| SCHEMBL19421350 | 0.63 | TYR (0.65) | ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105377253-A | Anti-viral compounds, pharmaceutical compositions, and methods of use thereof | KINETA INC | 2016-03-02 | — | — | CN | disclosed |