Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 3/20 | 0.38 |
| ▸ | KLK1 | P06870 | 1/20 | 0.38 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.38 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.38 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SMO | Q99835 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 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 | |
|---|---|---|---|---|
| SCHEMBL2714077 | 0.85 | SCN9A (0.50) | SCN9AHSD17B10MMP13 | |
| SCHEMBL2713199 | 0.84 | SCN9A (0.48) | SCN9AADORA2AADORA1 | |
| SCHEMBL2718447 | 0.84 | MAPT (0.46) | SCN9AMMP13LMNAHTT | |
| SCHEMBL2715396 | 0.82 | SCN9A (0.48) | SCN9AMMP13EPHX2NR1H4ADORA2A | |
| SCHEMBL18266303 | 0.82 | SCN9A (0.47) | SCN9AHSD17B10MMP13LMNAHTT | |
| SCHEMBL4550420 | 0.81 | ROCK2 (0.48) | SCN9AHSD17B10MMP13LMNAHTT | |
| SCHEMBL2715099 | 0.80 | SCN9A (0.56) | SCN9A | |
| SCHEMBL2714516 | 0.80 | SCN9A (0.49) | SCN9AEPHX2NR1H4ADORA3ADORA2A | |
| SCHEMBL2716475 | 0.80 | KMT2A (0.55) | SCN9AMMP13LMNATSHRMEN1 | |
| SCHEMBL2714916 | 0.80 | EPHX2 (0.53) | SCN9AEPHX2NR1H4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2630122-B1 | ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS | RAQUALIA PHARMA INC (JP) | 2016-11-30 | — | — | EP | disclosed |