Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 1/20 | 0.41 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.38 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7166755 | 0.85 | TACR3 (0.51) | TACR3CTRB1P2RX4KDM1AMAOA | |
| SCHEMBL4231904 | 0.85 | TACR3 (0.46) | TACR3CTRB1P2RX4KDM1AMAOA | |
| SCHEMBL4232805 | 0.84 | TACR3 (0.43) | TACR3CTRB1P2RX4KDM1AMAOA | |
| SCHEMBL3375069 | 0.80 | TDP1 (0.47) | TACR3CTRB1P2RX4KDM1AMAOA | |
| SCHEMBL13309267 | 0.79 | NPC1 (0.48) | TACR3CTRB1P2RX4KDM1AMAOA | |
| SCHEMBL4235703 | 0.77 | P2RX4 (0.40) | TACR3CTRB1P2RX4KDM1AMAOA | |
| SCHEMBL29015481 | 0.77 | HTR6 (0.46) | KDM1AMAOARCOR1KMT2AMEN1 | |
| SCHEMBL30772188 | 0.76 | KMT2A (0.41) | TACR3CTRB1P2RX4KDM1AMAOA | |
| SCHEMBL7162130 | 0.74 | L3MBTL1 (0.53) | CTRB1P2RX4KMT2AMEN1NPSR1 | |
| SCHEMBL16399234 | 0.73 | TACR3 (0.53) | TACR3CTRB1P2RX4KDM1AMAOA |
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-2009115874-A2 | NOVEL HETEROCYCLIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION | MATRIX LABORATORIES LTD. (IN) | 2009-09-24 | — | — | WO | disclosed |