Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | TDO2 | P48775 | 2/20 | 0.34 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | TERT | O14746 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL20141623 | 0.77 | HDAC4 (0.37) | ROCK2HDAC4CYP19A1IDO1TDO2 | |
| SCHEMBL7297048 | 0.75 | SLC6A2 (0.42) | IDO1TDO2CYP2D6HRH1ALDH1A1 | |
| SCHEMBL20139617 | 0.73 | HDAC4 (0.41) | ROCK2HDAC4HPGDHSD17B10ALOX5AP | |
| SCHEMBL6203371 | 0.73 | SMN1; SMN2 (0.40) | HDAC4ALDH1A1FEN1 | |
| SCHEMBL3910983 | 0.71 | TAAR1 (0.60) | CYP19A1IDO1TDO2CYP2D6HRH1 | |
| SCHEMBL20161327 | 0.70 | NPC1 (0.38) | CYP19A1IDO1LOXL2CYP2D6TAAR1 | |
| SCHEMBL20773226 | 0.70 | CTSA (0.44) | IDO1TDO2TAAR1 | |
| SCHEMBL20139680 | 0.70 | HDAC4 (0.39) | ROCK2HDAC4HPGDKMT2AHSD17B10 | |
| SCHEMBL5739585 | 0.69 | HDAC4 (0.34) | HDAC4HPGDHSD17B10GAA | |
| SCHEMBL7521138 | 0.68 | SLC6A2 (0.43) | CYP2D6HRH1ALDH1A1HTR2ATAAR1 |
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 |