Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.40 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | FOS | P01100 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | JUN | P05412 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL25046085 | 0.80 | TRPV4 (0.62) | TP53PTGS2ALPLSMN1; SMN2TUBB1 | |
| SCHEMBL19938065 | 0.80 | PKM (0.50) | TP53PTGS2ALPLSMN1; SMN2TUBB1 | |
| SCHEMBL16308959 | 0.80 | TP53 (0.49) | TP53PTGS2ALPLSMN1; SMN2TUBB1 | |
| SCHEMBL30184732 | 0.80 | TRPV4 (0.62) | TP53PTGS2ALPLSMN1; SMN2TUBB1 | |
| SCHEMBL12180447 | 0.78 | MCOLN3 (0.53) | ALPLSMN1; SMN2TRPV4HTTCA2 | |
| SCHEMBL21276078 | 0.78 | L3MBTL1 (0.41) | TP53PTGS2SMN1; SMN2CA2ALDH1A1 | |
| SCHEMBL10886489 | 0.77 | TP53 (0.47) | TP53PTGS2ALPLSMN1; SMN2TUBB1 | |
| SCHEMBL20364526 | 0.77 | GAA (0.49) | TRPV4HTTCA2ALDH1A1LMNA | |
| SCHEMBL13588814 | 0.72 | HTR6 (0.56) | CA2ALDH1A1MAPTMAPK1L3MBTL1 | |
| SCHEMBL10962659 | 0.71 | SMN1; SMN2 (0.61) | TP53ALPLSMN1; SMN2TUBB1HTT |
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-2595989-B1 | HETEROCYCLIC CHROMENE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS | VERTEX PHARMA (US) | 2016-07-13 | — | — | EP | disclosed |
| WO-2011140425-A1 | HETEROCYCLIC CHROMENE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-11-10 | — | — | WO | disclosed |