Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 3/20 | 0.40 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | MAPKAPK2 | P49137 | 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 | |
|---|---|---|---|---|
| SCHEMBL5071497 | 0.81 | NFE2L2 (0.38) | HDAC4CES2CES1 | |
| SCHEMBL20139709 | 0.81 | HDAC4 (0.38) | HDAC4SLC6A9 | |
| SCHEMBL9347326 | 0.77 | CES2 (0.42) | CES2CES1 | |
| SCHEMBL20139617 | 0.74 | HDAC4 (0.41) | HDAC4CES2CES1MAPKAPK2 | |
| SCHEMBL17316873 | 0.73 | HDAC4 (0.49) | HDAC4SLC6A9CES2CES1 | |
| SCHEMBL20141623 | 0.72 | HDAC4 (0.37) | HDAC4SLC6A9 | |
| SCHEMBL1515751 | 0.71 | IDO1 (0.46) | CES2CES1 | |
| SCHEMBL14743495 | 0.68 | CES2 (0.36) | HDAC4CES2CES1 | |
| SCHEMBL2724490 | 0.68 | CES2 (0.36) | CES2CES1 | |
| SCHEMBL9363514 | 0.68 | IDO1 (0.36) | HDAC4CES2CES1 |
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-3538520-A2 | SGC STIMULATORS | Cyclerion Therapeutics, Inc. (US) | 2019-09-18 | — | — | EP | disclosed |
| WO-2018089330-A2 | SGC STIMULATORS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2018-05-17 | — | — | WO | disclosed |