Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.53 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
| ▸ | HTR2B | P41595 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 7/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11081196 | 0.86 | POLB (0.52) | CYP3A4MAOBNPC1LMNAGAA | |
| SCHEMBL11085958 | 0.85 | CYP3A4 (0.54) | CYP3A4MAOBMAPTALDH1A1NPC1 | |
| Acetic Acid SCHEMBL11077477 | 0.82 | CYP3A4 (0.57) | CYP3A4HTR2CHTR2BMAOBMAPT | |
| SCHEMBL11086777 | 0.81 | MEN1 (0.60) | MAPTALDH1A1MAPK1NPC1RAB9A | |
| SCHEMBL11082071 | 0.78 | MAPT (0.58) | MAPTALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11083167 | 0.77 | RXFP1 (0.53) | MAPTSMN1; SMN2TP53HSD17B10RXFP1 | |
| SCHEMBL11082254 | 0.74 | MAPT (0.48) | CYP3A4MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL11080819 | 0.74 | LMNA (0.47) | MAPTALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11075368 | 0.71 | MAPT (0.49) | MAOBMAPTALDH1A1NPC1RAB9A | |
| SCHEMBL28817989 | 0.70 | KDM4E (0.50) | CYP3A4MAPTALDH1A1SMN1; SMN2TP53 |
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-4450167-A | TRANQUILIZERS; PSYCHOLOGICAL DISORDERS | ROUSSEL UCLAF (FR) | 1984-05-22 | — | — | US | disclosed |