Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6235501 | 0.75 | TRPV1 (0.56) | TRPV1PKMGAAMAPTKMT2A | |
| SCHEMBL1245168 | 0.75 | CYP1A2 (0.57) | TRPV1PKMGAAMAPTKMT2A | |
| SCHEMBL6661840 | 0.72 | TRPV1 (0.60) | TRPV1PKMGAAMAPTKMT2A | |
| SCHEMBL28228079 | 0.72 | CYP1A2 (0.54) | TRPV1PKMGAAMAPTKMT2A | |
| SCHEMBL14197221 | 0.70 | SMN1; SMN2 (0.49) | GLAKMT2AMAPK1HDAC3HDAC4 | |
| SCHEMBL23484271 | 0.70 | PKM (0.50) | PKMGAAMAPTLMNAHSP90AA1 | |
| SCHEMBL11084146 | 0.70 | HSP90AA1 (0.48) | TRPV1PKMGAAMAPTKMT2A | |
| SCHEMBL69265 | 0.69 | CYP1A2 (0.58) | TRPV1PKMGAAMAPTKMT2A | |
| SCHEMBL4436997 | 0.69 | TRPV1 (0.74) | TRPV1PKMGAAMAPTKMT2A | |
| SCHEMBL6252526 | 0.68 | CYP1A2 (0.57) | TRPV1PKMGAAMAPTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4435397-A | ADRENERGIC BLOCKING AGENTS, 4-(3-ARYLOXY-2-HYDROXYPROPYL) SUBSTITUTED | NIPPON SHINYAKU CO., LTD. (JP) | 1984-03-06 | — | — | US | disclosed |