Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 8/20 | 0.36 |
| ▸ | ACACB | O00763 | 2/20 | 0.36 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 2/20 | 0.31 |
| ▸ | RET | P07949 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9160634 | 0.95 | CYP2A6 (0.36) | CYP2A6FFAR1ACACBEGLN1SNCA | |
| SCHEMBL9766643 | 0.89 | FFAR1 (0.36) | CYP2A6FFAR1ACACBFFAR4 | |
| SCHEMBL9158273 | 0.88 | FFAR1 (0.40) | FFAR1ACACBFFAR4 | |
| SCHEMBL9153691 | 0.85 | FFAR1 (0.39) | FFAR1FFAR4 | |
| SCHEMBL9766633 | 0.85 | HSD17B10 (0.39) | FFAR1LMNAFFAR4 | |
| SCHEMBL9160297 | 0.84 | FFAR1 (0.37) | CYP2A6FFAR1ACACBEGLN1SNCA | |
| SCHEMBL9158620 | 0.84 | HSD17B10 (0.42) | FFAR1LMNAFFAR4 | |
| SCHEMBL9158563 | 0.84 | FFAR1 (0.38) | FFAR1ACACBFFAR4 | |
| SCHEMBL9157598 | 0.83 | HSD17B10 (0.44) | FFAR1LMNAFFAR4 | |
| SCHEMBL9155712 | 0.82 | TSHR (0.43) | FFAR1 |
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-0445248-B1 | PYRIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 1995-03-08 | — | — | EP | disclosed |
| US-5205962-A | Stable liquid crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-04-27 | — | — | US | disclosed |