Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.49 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10938347 | 1.00 | MAPK1 (0.52) | MAPK1NPSR1L3MBTL1MAPTKMT2A | |
| SCHEMBL7368742 | 0.86 | MAPK1 (0.60) | MAPK1NPSR1MAPTKMT2AMEN1 | |
| SCHEMBL7368740 | 0.86 | MAPK1 (0.60) | MAPK1NPSR1MAPTKMT2AMEN1 | |
| SCHEMBL30269691 | 0.78 | HTT (0.65) | MAPK1NPSR1MAPTKMT2AMEN1 | |
| SCHEMBL1643 | 0.78 | HTT (0.65) | MAPK1NPSR1MAPTKMT2AMEN1 | |
| SCHEMBL29364482 | 0.78 | HTT (0.65) | MAPK1NPSR1MAPTKMT2AMEN1 | |
| SCHEMBL1218 | 0.78 | HTT (0.65) | MAPK1NPSR1MAPTKMT2AMEN1 | |
| SCHEMBL9486033 | 0.78 | HTT (0.65) | MAPK1NPSR1MAPTKMT2AMEN1 | |
| SCHEMBL3262039 | 0.78 | CYP1A1 (0.51) | MAPK1NPSR1MAPTKMT2AMEN1 | |
| SCHEMBL3262042 | 0.78 | CYP1A1 (0.51) | MAPK1NPSR1MAPTKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4521422-A | ANTICONVULSANT, ANTIEPILEPTIC AGENTS, SEDATIVES, MUSCLE RELAXANTS | AMERICAN CYANAMID COMPANY (US) | 1985-06-04 | — | — | US | disclosed |
| EP-0129847-A2 | Aryl and heteroaryl[7-(aryl and heteroaryl)-pyrazolo-[1,5-a]-pyrimidin-3-yl]methanones | AMERICAN CYANAMID COMPANY (US) | 1985-01-02 | — | — | EP | disclosed |