Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 10/20 | 0.41 |
| ▸ | RARB | P10826 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | SPHK2 | Q9NRA0 | 6/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10692937 | 1.00 | SPHK1 (0.41) | SPHK1RARBTDP1L3MBTL1OPRM1 | |
| SCHEMBL10692430 | 0.98 | SPHK1 (0.43) | SPHK1RARBNPC1MAPTSTAT3 | |
| SCHEMBL10692930 | 0.86 | SPHK1 (0.40) | SPHK1RARBTDP1L3MBTL1NPC1 | |
| SCHEMBL10692925 | 0.86 | SPHK1 (0.40) | SPHK1RARBTDP1L3MBTL1NPC1 | |
| SCHEMBL11076068 | 0.86 | SPHK1 (0.40) | SPHK1RARBTDP1L3MBTL1NPC1 | |
| SCHEMBL11076070 | 0.86 | SPHK1 (0.40) | SPHK1RARBTDP1L3MBTL1NPC1 | |
| SCHEMBL11066960 | 0.84 | SPHK1 (0.39) | SPHK1RARBTDP1L3MBTL1NPC1 | |
| SCHEMBL10692428 | 0.84 | SPHK1 (0.42) | SPHK1RARBNPC1MAPTSTAT3 | |
| SCHEMBL11066955 | 0.84 | SPHK1 (0.39) | SPHK1RARBTDP1L3MBTL1NPC1 | |
| SCHEMBL10341000 | 0.84 | SPHK1 (0.42) | SPHK1RARBNPC1MAPTSTAT3 |
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-0220254-A1 | BENZONITRILES. | MERCK PATENT GMBH (DE) | 1987-05-06 | — | — | EP | disclosed |
| WO-1986006372-A1 | BENZONITRILE | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1986-11-06 | — | — | WO | disclosed |