Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 1/20 | 0.40 |
| ▸ | SLC25A5 | P05141 | 2/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20376450 | 1.00 | S100A4 (0.40) | S100A4SLC25A5GSK3BMAOBTP53 | |
| SCHEMBL20376256 | 0.82 | S100A4 (0.39) | S100A4SLC25A5 | |
| SCHEMBL20208493 | 0.82 | S100A4 (0.39) | S100A4SLC25A5 | |
| SCHEMBL20201727 | 0.82 | S100A4 (0.39) | S100A4SLC25A5 | |
| SCHEMBL20201723 | 0.80 | HDAC4 (0.42) | S100A4SLC25A5MAOB | |
| SCHEMBL20201781 | 0.80 | HDAC4 (0.42) | S100A4SLC25A5MAOB | |
| SCHEMBL20207026 | 0.74 | S100A4 (0.53) | S100A4SLC25A5MAOBTP53ACHE | |
| SCHEMBL9728915 | 0.73 | S100A4 (0.40) | S100A4LMNA | |
| SCHEMBL26489317 | 0.73 | S100A4 (0.45) | S100A4GSK3BTP53ACHELMNA | |
| SCHEMBL10440488 | 0.71 | S100A4 (0.50) | S100A4SLC25A5MAOBTP53ACHE |
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-2018098206-A1 | HYDANTOIN CONTAINING DEOXYURIDINE TRIPHOSPHATASE INHIBITORS | CV6 THERAPEUTICS (NI) LIMITED (GB) | 2018-05-31 | — | — | WO | disclosed |