Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKDC | P78527 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.34 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.34 |
| ▸ | CHRNG | P07510 | 1/20 | 0.34 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | CHRND | Q07001 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13740852 | 0.87 | PRKDC (0.36) | PRKDCMCHR1ALDH1A1POLBMAPT | |
| SCHEMBL13738143 | 0.86 | MCHR1 (0.35) | PRKDCMCHR1ALDH1A1POLBMAPT | |
| SCHEMBL13739554 | 0.76 | MAPT (0.39) | PRKDCNPSR1MEN1KMT2AALDH1A1 | |
| SCHEMBL20772782 | 0.76 | HSD17B2 (0.40) | PRKDCNPSR1CHRNA1CHRNGCHRNB1 | |
| SCHEMBL27940194 | 0.73 | NTSR1 (0.44) | CYP3A4CYP2D6CYP2C19HRH3MCHR1 | |
| SCHEMBL20772370 | 0.68 | HSD17B2 (0.43) | PRKDCMEN1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL13738624 | 0.68 | THRB (0.43) | NPSR1ALDH1A1POLBMAPTLMNA | |
| SCHEMBL20772829 | 0.66 | HSD17B2 (0.39) | PRKDCNPSR1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL13832852 | 0.66 | USP14 (0.56) | NPSR1MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL10279359 | 0.65 | TRPV1 (0.35) | NPSR1MEN1KMT2AMCHR1ALDH1A1 |
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-2707101-A1 | PROTEOSTASIS REGULATORS | Proteostasis Therapeutics, Inc. (US) | 2014-03-19 | — | — | EP | disclosed |
| WO-2012154967-A1 | PROTEOSTASIS REGULATORS | PROTEOSTASIS THERAPEUTICS, INC. (US) | 2012-11-15 | — | — | WO | disclosed |