Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 10/20 | 0.62 |
| ▸ | NPC1 | O15118 | 8/20 | 0.55 |
| ▸ | RAB9A | P51151 | 8/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.51 |
| ▸ | RELA | Q04206 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | TTR | P02766 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL19090054 | 0.97 | S1PR1 (0.66) | S1PR1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL14061787 | 0.87 | S1PR1 (0.52) | S1PR1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL14153146 | 0.86 | S1PR1 (0.61) | S1PR1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL14153246 | 0.86 | S1PR1 (0.61) | S1PR1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL24325675 | 0.85 | NPC1 (0.53) | S1PR1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL14153256 | 0.84 | S1PR1 (0.50) | S1PR1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL14153795 | 0.84 | S1PR1 (0.47) | S1PR1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL14060225 | 0.84 | RAB9A (0.53) | S1PR1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL26524272 | 0.84 | S1PR1 (0.48) | S1PR1NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL19091431 | 0.83 | S1PR1 (0.61) | S1PR1NPC1RAB9AMAPTSMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012162635-A1 | METABOTROPIC GLUTAMATE RECEPTORS 5 MODULATORS AND METHODS OF USE THEREOF | SUNOVION PHARMACEUTICALS INC. (US) | 2012-11-29 | — | — | WO | disclosed |