Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 7/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 3/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30660185 | 0.83 | MAPK1 (0.39) | KMT2AALDH1A1MAPK1KDM4ECYP2D6 | |
| SCHEMBL9435770 | 0.78 | MAPK1 (0.50) | KMT2AMAPK1CYP2D6METHSD11B1 | |
| SCHEMBL1698558 | 0.75 | TOP2A (0.35) | ALDH1A1 | |
| SCHEMBL11082747 | 0.75 | KMT2A (0.48) | KMT2AALDH1A1CYP2D6METMEN1 | |
| SCHEMBL8401531 | 0.74 | CYP2D6 (0.46) | KMT2AALDH1A1MAPK1CYP2D6POLB | |
| SCHEMBL13891664 | 0.73 | ALDH1A1 (0.58) | KMT2AALDH1A1MAPK1KDM4ECYP2D6 | |
| SCHEMBL19231724 | 0.73 | KMT2A (0.42) | KMT2AALDH1A1MAPK1CYP2D6MEN1 | |
| SCHEMBL19231723 | 0.73 | KMT2A (0.42) | KMT2AALDH1A1MAPK1CYP2D6MEN1 | |
| SCHEMBL25326807 | 0.72 | TOP2A (0.33) | ALDH1A1 | |
| SCHEMBL9180587 | 0.72 | TOP2A (0.33) | ALDH1A1 |
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-2643000-A2 | THERAPEUTIC PIPERAZINES | Dart Neuroscience (Cayman) Ltd (KY) | 2013-10-02 | — | — | EP | disclosed |
| WO-2012040258-A2 | THERAPEUTIC PIPERAZINES | HELICON THERAPEUTICS, INC. (US) | 2012-03-29 | — | — | WO | disclosed |