Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.45 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.45 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.45 |
| ▸ | DGKA | P23743 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8922442 | 0.98 | PRSS1 (0.47) | CYP1A2PRSS1PRSS2PRSS3DGKA | |
| SCHEMBL8924985 | 0.98 | PRSS1 (0.47) | CYP1A2PRSS1PRSS2PRSS3DGKA | |
| SCHEMBL8923849 | 0.94 | CYP1A2 (0.48) | CYP1A2PRSS1PRSS2PRSS3DGKA | |
| SCHEMBL8922161 | 0.88 | CYP1A2 (0.55) | CYP1A2PRSS1PRSS2PRSS3DGKA | |
| SCHEMBL11853523 | 0.88 | DGKA (0.54) | CYP1A2PRSS1PRSS2PRSS3DGKA | |
| SCHEMBL11847129 | 0.88 | DGKA (0.54) | CYP1A2PRSS1PRSS2PRSS3DGKA | |
| SCHEMBL3764429 | 0.88 | DGKA (0.54) | CYP1A2PRSS1PRSS2PRSS3DGKA | |
| Hydrochloric Acid SCHEMBL11847579 | 0.86 | DGKA (0.52) | CYP1A2PRSS1PRSS2PRSS3DGKA | |
| SCHEMBL20824974 | 0.86 | CYP1A2 (0.61) | CYP1A2PRSS1PRSS2PRSS3DGKA | |
| SCHEMBL11859829 | 0.84 | CYP1A2 (0.54) | CYP1A2PRSS1PRSS2PRSS3DGKA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5639770-A | SUPEROXIDE INHIBITOR | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1997-06-17 | — | — | US | disclosed |
| EP-0600092-A1 | THIAZOLE DERIVATIVE | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-06-08 | — | — | EP | disclosed |