Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | KMO | O15229 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.38 |
| ▸ | PLK1 | P53350 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8919447 | 0.83 | KMO (0.41) | HSD17B10ALDH1A1KDM4EKMONPC1 | |
| SCHEMBL8919804 | 0.80 | LMNA (0.42) | HSD17B10ALDH1A1KDM4ENPC1PKM | |
| SCHEMBL7316292 | 0.76 | NPC1 (0.63) | HSD17B10ALDH1A1KDM4ENPC1LMNA | |
| SCHEMBL17418888 | 0.73 | PDE4B (0.43) | HSD17B10ALDH1A1KDM4ENPC1PKM | |
| SCHEMBL8918139 | 0.73 | HSD17B10 (0.38) | HSD17B10ALDH1A1KMONPC1TSHR | |
| SCHEMBL9646262 | 0.72 | HTR1A (0.54) | — | |
| SCHEMBL8627148 | 0.70 | PDE4B (0.36) | HSD17B10ALDH1A1KDM4EKMONPC1 | |
| SCHEMBL7328412 | 0.70 | HSD17B10 (0.53) | HSD17B10ALDH1A1KDM4ENPC1PKM | |
| SCHEMBL25865447 | 0.68 | HSD17B10 (0.39) | HSD17B10ALDH1A1NPC1LMNATSHR | |
| SCHEMBL11343195 | 0.68 | MIF (0.60) | ALDH1A1LMNATSHRMAPK1L3MBTL1 |
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-5618819-A | ANALGESICS | ADIR ET COMPAGNIE (FR) | 1997-04-08 | — | — | US | disclosed |
| EP-0691339-A1 | Amine derivatives of 1,3-dihydro-2H-pyrrolo(2,3-b)pyridin-2-ones and oxazolo(4,5-b)pyridin-2(3H)-ones, their process of preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1996-01-10 | — | — | EP | disclosed |