Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.39 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 2/20 | 0.35 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6686249 | 0.84 | KMT2A (0.44) | TAS1R3TAS1R1KMT2ATSHRMEN1 | |
| SCHEMBL6693529 | 0.84 | TP53 (0.48) | TAS1R3TAS1R1KMT2ATSHRMEN1 | |
| SCHEMBL4797529 | 0.82 | CTSL (0.42) | CTSLCTSSCTSK | |
| SCHEMBL6689442 | 0.80 | CTSL (0.52) | KMT2ATSHRMEN1EPHX1LRRK2 | |
| SCHEMBL6688117 | 0.79 | TAS1R3 (0.45) | TAS1R3TAS1R1KMT2ATSHRMEN1 | |
| SCHEMBL6690323 | 0.76 | CTSS (0.40) | TSHREPHX1CTSLCTSSCTSK | |
| SCHEMBL6693994 | 0.75 | CTSS (0.42) | TSHREPHX1CTSLCTSSCTSK | |
| SCHEMBL4797524 | 0.74 | MMP1 (0.36) | KMT2AMEN1ADRA1AADRA2AADRA2C | |
| SCHEMBL6694461 | 0.74 | ALDH1A1 (0.54) | EPHX1CTSLCTSSCTSK | |
| SCHEMBL5499714 | 0.72 | ALDH1A1 (0.52) | EPHX1CTSLCTSSCTSK |
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-2004084843-A2 | INHIBITORS OF CATHEPSIN S | IRM LLC (BM) | 2004-10-07 | — | — | WO | disclosed |