Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | CMA1 | P23946 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 6/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | F11 | P03951 | 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 | |
|---|---|---|---|---|
| SCHEMBL13809007 | 0.91 | GRIN2C (0.43) | GRIN2CCMA1P2RX7MEN1KMT2A | |
| SCHEMBL13809253 | 0.85 | GRIN2C (0.43) | GRIN2CP2RX7MEN1KMT2AABCB1 | |
| SCHEMBL13809228 | 0.81 | GRIN2C (0.43) | GRIN2CP2RX7MEN1KMT2AABCB1 | |
| SCHEMBL13809244 | 0.79 | GRIN2C (0.36) | GRIN2CCMA1MEN1KMT2ALMNA | |
| SCHEMBL13809234 | 0.78 | GRIN2C (0.40) | GRIN2CMEN1KMT2AABCB1ABCG2 | |
| SCHEMBL13809231 | 0.76 | GRIN2C (0.39) | GRIN2CP2RX7ABCB1ABCG2 | |
| SCHEMBL13809251 | 0.76 | GRIN2C (0.49) | GRIN2CMEN1KMT2ALMNANPC1 | |
| SCHEMBL13809243 | 0.75 | KIF11 (0.53) | GRIN2CP2RX7MEN1KMT2ALMNA | |
| SCHEMBL10025894 | 0.71 | MAPT (0.41) | MEN1KMT2ALMNATP53MAPT | |
| SCHEMBL13809019 | 0.66 | GRIN2C (0.44) | GRIN2CMEN1KMT2ALMNATP53 |
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-2009073545-A2 | TETRAHYDRO-ISOQUINOLINE PPAT INHIBITORS AS ANTIBACTERIAL AGENTS | MAXTHERA, INC. (US) | 2009-06-11 | — | — | WO | disclosed |