Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 1/20 | 0.53 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.53 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6497259 | 1.00 | GRIN1 (0.53) | GRIN1GRIN2BG6PC1TAAR1EPHX2 | |
| SCHEMBL1005726 | 0.80 | G6PC1 (0.47) | GRIN1GRIN2BG6PC1TAAR1EPHX2 | |
| SCHEMBL9137067 | 0.80 | MAOB (0.52) | GRIN1GRIN2BG6PC1EPHX2EPHX1 | |
| SCHEMBL11234537 | 0.80 | MAOB (0.52) | GRIN1GRIN2BG6PC1EPHX2EPHX1 | |
| SCHEMBL9137069 | 0.80 | MAOB (0.52) | GRIN1GRIN2BG6PC1EPHX2EPHX1 | |
| SCHEMBL18409970 | 0.80 | GRIN1 (0.43) | GRIN1GRIN2BG6PC1EPHX2EPHX1 | |
| Cyclooctane SCHEMBL18187569 | 0.79 | SIGMAR1 (0.58) | TAAR1SMN1; SMN2ALOX12SIGMAR1 | |
| SCHEMBL15571166 | 0.78 | TAAR1 (0.49) | GRIN1GRIN2BTAAR1EPHX2NPC1 | |
| SCHEMBL8716285 | 0.77 | EPHX2 (0.45) | G6PC1EPHX2HTTL3MBTL1EPHX1 | |
| SCHEMBL15314328 | 0.77 | LTB4R (0.51) | GRIN1GRIN2BG6PC1TAAR1EPHX2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6974607-B2 | Pyrans as liquid crystals | MERCK PATENT GMBH (DE) | 2005-12-13 | — | — | US | disclosed |