Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.51 |
| ▸ | HPGD | P15428 | 5/20 | 0.51 |
| ▸ | HTR6 | P50406 | 11/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 4/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | CRHBP | P24387 | 1/20 | 0.46 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8030043 | 0.90 | HTR6 (0.50) | KDM4EHPGDHTR6ALDH1A1RXFP1 | |
| SCHEMBL8021669 | 0.86 | HPGD (0.45) | KDM4EHPGDHTR6ALDH1A1RXFP1 | |
| SCHEMBL8019100 | 0.86 | HTR6 (0.57) | HTR6RXFP1MAPTGAATP53 | |
| SCHEMBL8018264 | 0.79 | HTR6 (0.52) | HTR6RXFP1MAPTTP53 | |
| SCHEMBL8018278 | 0.73 | HPGD (0.60) | KDM4EHPGDHTR6ALDH1A1RXFP1 | |
| SCHEMBL8021786 | 0.73 | KDM4E (0.72) | KDM4EHPGDHTR6ALDH1A1RXFP1 | |
| SCHEMBL14349689 | 0.71 | KDM4E (0.40) | KDM4EHPGDALDH1A1RXFP1NPSR1 | |
| SCHEMBL10666827 | 0.71 | KDM4E (0.40) | KDM4EHPGDALDH1A1RXFP1NPSR1 | |
| SCHEMBL10668591 | 0.71 | KDM4E (0.44) | KDM4EHPGDALDH1A1RXFP1NPSR1 | |
| SCHEMBL8028196 | 0.71 | HPGD (0.84) | KDM4EHPGDHTR6ALDH1A1RXFP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009093934-A2 | SUBSTITUTED 3-SULPHONYL-[1,2,3]TRIAZOLO [1,5-A]PYRIMIDINES-ANTAGONISTS OF SEROTONIN 5-HT6 RECEPTORS, MEDICINAL SUBSTANCE, PHARMACEUTICAL COMPOSITION, MEDICINAL PREPARATION AND METHODS FOR THE PRODUCTION THEREOF | ALLA CHEM, LLC (US) | 2009-07-30 | — | — | WO | disclosed |