Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | TDO2 | P48775 | 2/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | GOT1 | P17174 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL3712034 | 0.78 | HTR2A (0.54) | SLC6A9TAAR1HTR2ACYP1A2SLC6A2 | |
| SCHEMBL20139663 | 0.77 | ROCK2 (0.39) | HDAC4IDO1TDO2ROCK2TAAR1 | |
| SCHEMBL17316873 | 0.73 | HDAC4 (0.49) | HDAC4SLC6A9CYP1A2GAA | |
| SCHEMBL3910983 | 0.72 | TAAR1 (0.60) | IDO1TDO2TAAR1HTR2ACYP1A2 | |
| SCHEMBL20139604 | 0.72 | HDAC4 (0.40) | HDAC4SLC6A9 | |
| SCHEMBL7297048 | 0.70 | SLC6A2 (0.42) | IDO1TDO2HTR2ACYP2D6SLC6A2 | |
| SCHEMBL20161464 | 0.69 | TAAR1 (0.38) | IDO1TAAR1CYP1A2CYP19A1GOT1 | |
| SCHEMBL20139709 | 0.69 | HDAC4 (0.38) | HDAC4SLC6A9 | |
| SCHEMBL27490477 | 0.69 | CYP1A2 (0.40) | CYP1A2GOT1 | |
| SCHEMBL6001389 | 0.68 | HRH1 (0.54) | IDO1TDO2CNR2TAAR1HTR2A |
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 |