Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | MIF | P14174 | 2/20 | 0.31 |
| ▸ | CD74 | P04233 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CRHBP | P24387 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL8624408 | 0.89 | ALDH1A1 (0.36) | ALDH1A1KDM4EPDE10APIK3CDNPC1 | |
| SCHEMBL17418888 | 0.83 | PDE4B (0.43) | ALDH1A1KDM4EPDE10APIK3CDNPC1 | |
| SCHEMBL8624806 | 0.82 | HSD17B10 (0.35) | ALDH1A1KDM4EPDE10ASMN1; SMN2HSD17B10 | |
| SCHEMBL31667522 | 0.79 | NPC1 (0.35) | ALDH1A1KDM4ENPC1 | |
| SCHEMBL8917229 | 0.77 | ALDH1A1 (0.36) | ALDH1A1KDM4EPDE10APIK3CDSMN1; SMN2 | |
| SCHEMBL8918838 | 0.72 | DRD4 (0.51) | KMT2A | |
| SCHEMBL17418949 | 0.71 | GSK3A (0.37) | ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL25865421 | 0.68 | ALDH1A1 (0.43) | ALDH1A1KDM4EPDE10APIK3CDNPC1 | |
| SCHEMBL25865370 | 0.67 | HSD17B10 (0.45) | ALDH1A1KDM4EPDE10ANPC1SMN1; SMN2 | |
| SCHEMBL7316292 | 0.66 | NPC1 (0.63) | ALDH1A1KDM4EPIK3CDNPC1MIF |
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 |