Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | ADH1B | P00325 | 1/20 | 0.39 |
| ▸ | ADH1C | P00326 | 1/20 | 0.39 |
| ▸ | ADH1A | P07327 | 1/20 | 0.39 |
| ▸ | ADH4 | P08319 | 1/20 | 0.39 |
| ▸ | ADH7 | P40394 | 1/20 | 0.39 |
| ▸ | SHBG | P04278 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 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 | |
|---|---|---|---|---|
| SCHEMBL14810792 | 1.00 | HTT (0.46) | HTTEPHX1SIGMAR1ADH1BADH1C | |
| SCHEMBL28057484 | 0.89 | — | — | |
| SCHEMBL891398 | 0.89 | SIGMAR1 (0.50) | HTTEPHX1SIGMAR1 | |
| SCHEMBL25086700 | 0.85 | HTT (0.38) | HTTEPHX1SIGMAR1ADH1BADH1C | |
| SCHEMBL26456057 | 0.85 | HTT (0.38) | HTTEPHX1SIGMAR1ADH1BADH1C | |
| SCHEMBL23462691 | 0.82 | HTT (0.36) | HTTEPHX1SIGMAR1 | |
| SCHEMBL104714 | 0.81 | ADH1B (0.44) | HTTEPHX1SIGMAR1ADH1BADH1C | |
| SCHEMBL22899465 | 0.81 | ADH1B (0.44) | HTTEPHX1SIGMAR1ADH1BADH1C | |
| SCHEMBL14176594 | 0.81 | ADH1B (0.44) | HTTEPHX1SIGMAR1ADH1BADH1C | |
| SCHEMBL13995960 | 0.81 | HTT (0.45) | HTTEPHX1SIGMAR1ADH1BADH1C |
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 |
|---|---|---|---|---|---|---|---|
| EP-1255738-B1 | GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO | NEUROCRINE BIOSCIENCES INC (US) | 2012-03-07 | — | — | EP | disclosed |