Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.49 |
| ▸ | MEN1 | O00255 | 5/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL17870796 | 1.00 | SIGMAR1 (0.52) | SIGMAR1ALDH1A1L3MBTL1RAB9AMEN1 | |
| SCHEMBL19873822 | 0.83 | SIGMAR1 (0.49) | SIGMAR1ALDH1A1L3MBTL1RAB9AMEN1 | |
| SCHEMBL17870736 | 0.83 | ALDH1A1 (0.43) | SIGMAR1ALDH1A1L3MBTL1RAB9AMEN1 | |
| SCHEMBL17870738 | 0.83 | ALDH1A1 (0.43) | SIGMAR1ALDH1A1L3MBTL1RAB9AMEN1 | |
| SCHEMBL3958147 | 0.77 | HTT (0.44) | ALDH1A1L3MBTL1RAB9AMEN1KMT2A | |
| SCHEMBL27644978 | 0.75 | RAB9A (0.44) | SIGMAR1ALDH1A1L3MBTL1RAB9ASMN1; SMN2 | |
| SCHEMBL23236146 | 0.74 | DPP4 (0.44) | ALDH1A1L3MBTL1RAB9AMEN1KMT2A | |
| SCHEMBL31381443 | 0.72 | MEN1 (0.67) | ALDH1A1L3MBTL1RAB9AMEN1KMT2A | |
| SCHEMBL7647604 | 0.72 | MEN1 (0.67) | ALDH1A1L3MBTL1RAB9AMEN1KMT2A | |
| SCHEMBL2101463 | 0.71 | ALDH1A1 (0.70) | SIGMAR1ALDH1A1L3MBTL1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3237403-A1 | NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS | Galderma Research & Development (FR) | 2017-11-01 | — | — | EP | disclosed |
| WO-2016102882-A1 | NOVEL HETEROCYCLIC COMPOUNDS AND THE USE THEREOF IN MEDICINE AND IN COSMETICS | GALDERMA RESEARCH & DEVELOPMENT (FR) | 2016-06-30 | — | — | WO | disclosed |