Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 2/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 4/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GNAI3 | P08754 | 6/20 | 0.37 |
| ▸ | GNAO1 | P09471 | 6/20 | 0.37 |
| ▸ | GNAI1 | P63096 | 6/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11033011 | 0.94 | MEN1 (0.43) | TRPV1CNR1CNR2MEN1HTT | |
| SCHEMBL11029152 | 0.94 | TLR4 (0.42) | TLR4MEN1HTTKMT2AALDH1A1 | |
| SCHEMBL11029534 | 0.90 | CYP1A2 (0.43) | TLR4TRPV1MEN1HTTKMT2A | |
| SCHEMBL11029323 | 0.87 | PKM (0.42) | TLR4TRPV1CNR1CNR2MEN1 | |
| SCHEMBL11030484 | 0.85 | HTT (0.45) | TLR4TRPV1MEN1HTTKMT2A | |
| SCHEMBL10479607 | 0.85 | GNAI3 (0.47) | MEN1HTTKMT2AGNAI3GNAO1 | |
| SCHEMBL10479610 | 0.85 | GNAI3 (0.47) | MEN1HTTKMT2AGNAI3GNAO1 | |
| SCHEMBL11026807 | 0.85 | TLR4 (0.46) | TLR4MEN1HTTKMT2AALDH1A1 | |
| SCHEMBL11028782 | 0.84 | PKM (0.43) | TLR4MEN1HTTKMT2ATP53 | |
| SCHEMBL10479596 | 0.83 | GNAI3 (0.44) | MEN1HTTKMT2AGNAI3GNAO1 |
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-4432885-A | Decalins | HOFFMANN-LA ROCHE INC. (US) | 1984-02-21 | — | — | US | disclosed |