Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | TLR4 | O00206 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | LSS | P48449 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11027492 | 1.00 | CYP1A2 (0.41) | CYP1A2TLR4HTTMEN1KMT2A | |
| SCHEMBL11029306 | 0.98 | CYP1A2 (0.42) | CYP1A2TLR4HTTMEN1KMT2A | |
| SCHEMBL11032188 | 0.98 | CYP1A2 (0.42) | CYP1A2TLR4HTTMEN1KMT2A | |
| SCHEMBL19722643 | 0.98 | CYP1A2 (0.42) | CYP1A2TLR4HTTMEN1KMT2A | |
| SCHEMBL11028988 | 0.96 | CYP1A2 (0.43) | CYP1A2TLR4HTTMEN1KMT2A | |
| SCHEMBL11213430 | 0.94 | EPHX1 (0.41) | CYP1A2TLR4HTTMEN1KMT2A | |
| SCHEMBL11213433 | 0.94 | EPHX1 (0.41) | CYP1A2TLR4HTTMEN1KMT2A | |
| SCHEMBL11208942 | 0.94 | EPHX1 (0.41) | CYP1A2TLR4HTTMEN1KMT2A | |
| SCHEMBL11208940 | 0.94 | EPHX1 (0.41) | CYP1A2TLR4HTTMEN1KMT2A | |
| SCHEMBL11029064 | 0.94 | CYP1A2 (0.45) | CYP1A2TLR4HTTMEN1KMT2A |
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 |