Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.79 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.53 |
| ▸ | MAPT | P10636 | 9/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.53 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | NSD2 | O96028 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2319990 | 0.88 | TRPV1 (1.00) | TRPV1CYP3A4CYP2D6 | |
| SCHEMBL2320518 | 0.88 | TRPV1 (1.00) | TRPV1CYP3A4CYP2D6 | |
| SCHEMBL3758877 | 0.87 | TRPV1 (0.60) | TRPV1CYP3A4CYP2D6ALDH1A1MAPT | |
| SCHEMBL3758650 | 0.79 | TRPV1 (0.51) | TRPV1CYP3A4CYP2D6ALDH1A1MAPT | |
| SCHEMBL2317847 | 0.79 | TRPV1 (0.82) | TRPV1CYP3A4CYP2D6 | |
| SCHEMBL2315789 | 0.79 | TRPV1 (0.82) | TRPV1CYP3A4CYP2D6 | |
| SCHEMBL2323343 | 0.78 | TRPV1 (1.00) | TRPV1CYP3A4CYP2D6 | |
| SCHEMBL2315767 | 0.77 | TRPV1 (0.80) | TRPV1CYP3A4CYP2D6 | |
| SCHEMBL2320393 | 0.77 | TRPV1 (0.77) | TRPV1CYP3A4CYP2D6 | |
| SCHEMBL2321190 | 0.77 | TRPV1 (1.00) | TRPV1CYP3A4CYP2D6 |
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-2008059339-A2 | ISOQUINOLINE DERIVATIVES AS VANILLOID RECEPTOR MODULATORS | GLENMARK PHARMACEUTICALS S.A. (US) | 2008-05-22 | — | — | WO | disclosed |