Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NOS3 | P29474 | 2/20 | 0.45 |
| ▸ | NOS1 | P29475 | 2/20 | 0.45 |
| ▸ | NOS2 | P35228 | 2/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28013193 | 1.00 | TRPV1 (0.51) | TRPV1HPGDSMN1; SMN2NOS3NOS1 | |
| SCHEMBL31345008 | 0.88 | SOAT1 (0.43) | TRPV1HPGDSMN1; SMN2NOS3NOS1 | |
| SCHEMBL16610377 | 0.87 | MEN1 (0.61) | TRPV1HPGDSMN1; SMN2LMNAMEN1 | |
| SCHEMBL16610336 | 0.80 | TRPV1 (0.52) | TRPV1HPGDSMN1; SMN2PKMKDM4E | |
| SCHEMBL28012614 | 0.80 | TRPV1 (0.52) | TRPV1HPGDSMN1; SMN2PKMKDM4E | |
| SCHEMBL16610337 | 0.79 | TRPV1 (0.46) | TRPV1HPGDSMN1; SMN2NOS3NOS1 | |
| SCHEMBL16610366 | 0.79 | TRPV1 (0.46) | TRPV1HPGDSMN1; SMN2NOS3NOS1 | |
| SCHEMBL16610365 | 0.78 | TRPV1 (0.50) | TRPV1HPGDSMN1; SMN2NOS3NOS1 | |
| SCHEMBL28012612 | 0.78 | TRPV1 (0.50) | TRPV1HPGDSMN1; SMN2NOS3NOS1 | |
| SCHEMBL28663853 | 0.76 | TRPV1 (0.57) | TRPV1SMN1; SMN2PKMKDM4EPTGS2 |
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-2015043522-A1 | TRIFLUOROMETHYL-CONTAINING AMIDE ALKALOID, MANUFACTURING METHOD AND PHARMACEUTICAL USE THEREOF | 天士力制药集团股份有限公司 | 2015-04-02 | — | — | WO | disclosed |