Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | RET | P07949 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL13699528 | 1.00 | ALDH1A1 (0.52) | ALDH1A1GAAMAPTMAPK1HTT | |
| Hydrochloric Acid SCHEMBL3273754 | 0.98 | ALDH1A1 (0.54) | ALDH1A1GAAMAPTMAPK1HTT | |
| SCHEMBL3275466 | 0.90 | ALDH1A1 (0.47) | ALDH1A1GAAMAPTMAPK1HTT | |
| SCHEMBL13699537 | 0.90 | ALDH1A1 (0.47) | ALDH1A1GAAMAPTMAPK1HTT | |
| SCHEMBL13891162 | 0.90 | HTT (0.50) | ALDH1A1GAAMAPTMAPK1HTT | |
| SCHEMBL4164073 | 0.90 | ALDH1A1 (0.47) | ALDH1A1GAAMAPTMAPK1HTT | |
| SCHEMBL13891221 | 0.90 | HTT (0.50) | ALDH1A1GAAMAPTMAPK1HTT | |
| Hydrochloric Acid SCHEMBL3279850 | 0.88 | ALDH1A1 (0.49) | ALDH1A1GAAMAPTMAPK1HTT | |
| SCHEMBL9641990 | 0.88 | KDM4E (0.54) | ALDH1A1MAPTTSHRMEN1KMT2A | |
| SCHEMBL4407771 | 0.88 | AOC3 (0.53) | ALDH1A1TSHRMEN1KMT2AAOC3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-6312988-A | — | — | None | — | — | JP | disclosed |
| EP-0612745-B1 | Process for the preparation of 1,2,3,4,10,14b-hexahydro-2-methyldibenzo[c,f ]pyrazino[ 1,2-a] azepin and their salts | HEUMANN PHARMA GMBH & CO (DE) | 1998-12-09 | — | — | EP | disclosed |
| JP-H06312988-A | 1,2,3,4,10,14B-HEXAHYDRO-2-METHYL-DIBENZO(C,F)PYRAZIONO(1,2-A)AZEPIN AND PREPARATION OF ITS SALT | HEUMANN PHARMA GMBH & CO | 1994-11-08 | — | — | JP | disclosed |
| EP-0612745-A1 | Process for the preparation 1,2,3,4,10,14b-hexahydro-2-methyldibenzo c,f pyrazino 1,2-a azepin and their salts | HEUMANN PHARMA GmbH (DE) | 1994-08-31 | — | — | EP | disclosed |