Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 5/20 | 0.65 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | PLK1 | P53350 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | MMP13 | P45452 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | RAF1 | P04049 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2208745 | 0.84 | HPGD (0.63) | TRPV1HTTTSHRHPGDSMN1; SMN2 | |
| SCHEMBL10664357 | 0.83 | TRPV1 (0.61) | TRPV1HTTTSHRALDH1A1MAPT | |
| SCHEMBL28093663 | 0.81 | HPGD (0.59) | TRPV1HTTTSHRHPGDSMN1; SMN2 | |
| SCHEMBL9172082 | 0.81 | TRPV1 (0.58) | TRPV1HTTTSHRALDH1A1MAPT | |
| SCHEMBL2714104 | 0.81 | TRPV1 (0.57) | TRPV1HTTTSHRHPGDSMN1; SMN2 | |
| SCHEMBL10294113 | 0.79 | HPGD (0.66) | TRPV1HTTTSHRHPGDSMN1; SMN2 | |
| SCHEMBL850939 | 0.79 | ALDH1A1 (0.77) | TRPV1HTTTSHRALDH1A1MAPT | |
| SCHEMBL11757405 | 0.78 | NPC1 (0.59) | TRPV1TSHRALDH1A1HSD17B10 | |
| SCHEMBL17940319 | 0.78 | SCN9A (0.61) | TRPV1HTTTSHRALDH1A1MAPT | |
| SCHEMBL11434818 | 0.78 | TRPV1 (0.55) | TRPV1HTTTSHRHPGDSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104520296-B | Pyrrolopyridinone derivatives as TTX-S blocker | 拉夸里亚创药株式会社 | 2016-11-16 | — | — | CN | disclosed |
| CN-104520296-A | Pyrrolopyridinone derivatives as TTX-S blockers | RAQUALIA PHARMA INC | 2015-04-15 | — | — | CN | disclosed |