Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CCR2 | P41597 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 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 | |
|---|---|---|---|---|
| SCHEMBL10835575 | 0.83 | NOTUM (0.49) | GAAEPHX2NOTUMCYP3A4KCNH2 | |
| SCHEMBL7222099 | 0.81 | GAA (0.42) | GAAEPHX2GRM5NOTUMJAK2 | |
| SCHEMBL12989360 | 0.81 | ESR1 (0.40) | GAAMEN1KMT2AKCNH2 | |
| SCHEMBL23302371 | 0.78 | EPHX2 (0.58) | GAAEPHX2RAB9AMEN1KMT2A | |
| SCHEMBL28890862 | 0.78 | TRPM5 (0.35) | GRM5NOTUMTRPM5CYP1A2CYP3A4 | |
| SCHEMBL2417589 | 0.72 | GAA (0.66) | GAAEPHX2RAB9ANOTUMMEN1 | |
| SCHEMBL12988811 | 0.71 | TDO2 (0.41) | RAB9AMEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL25113382 | 0.71 | CYP3A4 (0.46) | RAB9AMEN1KMT2ACYP3A4CYP2C9 | |
| SCHEMBL10950640 | 0.70 | GAA (0.63) | GAAEPHX2RAB9ANOTUMMEN1 | |
| SCHEMBL30719692 | 0.70 | NOTUM (0.53) | GAANOTUMMEN1KMT2AJAK2 |
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-4621144-A | 1-phenyl-4-hydroxypyrazole derivatives | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1986-11-04 | — | — | US | claimed |