Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7386107 | 0.87 | SMN1; SMN2 (0.39) | CYP2C19ALDH1A1THRBCYP2C9HSD17B10 | |
| SCHEMBL8486193 | 0.85 | HRH4 (0.45) | CTSSCTSK | |
| SCHEMBL8486197 | 0.85 | HRH4 (0.45) | CTSSCTSK | |
| SCHEMBL9875934 | 0.84 | ALDH1A1 (0.53) | CYP2C19GAAALDH1A1THRBCYP2C9 | |
| SCHEMBL9875926 | 0.84 | ALDH1A1 (0.53) | CYP2C19GAAALDH1A1THRBCYP2C9 | |
| SCHEMBL7384389 | 0.80 | TAS1R3 (0.36) | GAAHDAC6 | |
| SCHEMBL7380911 | 0.80 | ITGB2 (0.51) | KMT2A | |
| SCHEMBL9551271 | 0.77 | ALDH1A1 (0.53) | CYP2C19GAAALDH1A1THRBCYP2C9 | |
| SCHEMBL10436048 | 0.77 | OPRK1 (0.55) | CYP2C19ALDH1A1THRBCYP2C9HSD17B10 | |
| SCHEMBL10436049 | 0.77 | ALDH1A1 (0.53) | CYP2C19GAAALDH1A1THRBCYP2C9 |
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-4870183-A | RENIN INHIBITORS, HYPOTENSIVES | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 1989-09-26 | — | — | US | disclosed |
| EP-0252727-A1 | Novel amino acid derivatives | Kissei Pharmaceutical Co. Ltd. (JP) | 1988-01-13 | — | — | EP | disclosed |