Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | PYGL | P06737 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 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 | |
|---|---|---|---|---|
| SCHEMBL8630678 | 0.92 | AVPR2 (0.38) | ALDH1A1MAPTKMT2AHTTMEN1 | |
| SCHEMBL8630766 | 0.89 | AVPR2 (0.41) | POLBMAPTKMT2ATP53 | |
| SCHEMBL8627536 | 0.89 | KCNMA1 (0.35) | KCNMA1POLBPYGLALDH1A1GAA | |
| SCHEMBL8629507 | 0.84 | KCNMA1 (0.36) | KCNMA1POLBPYGLALDH1A1GAA | |
| SCHEMBL8627538 | 0.83 | KCNMA1 (0.36) | KCNMA1POLBPYGLALDH1A1GAA | |
| SCHEMBL8634463 | 0.82 | KMT2A (0.35) | KCNMA1POLBPYGLALDH1A1GAA | |
| SCHEMBL8634667 | 0.82 | AVPR2 (0.51) | MAPTKMT2AHTTLMNATP53 | |
| SCHEMBL8627398 | 0.80 | AVPR2 (0.37) | ALDH1A1GAAMAPTKMT2AHTT | |
| SCHEMBL8627187 | 0.77 | AVPR2 (0.40) | POLBMAPTKMT2ATP53 | |
| SCHEMBL8634457 | 0.77 | TP53 (0.34) | KCNMA1POLBPYGLALDH1A1GAA |
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-5753644-A | Vasopressin antagonist and oxytocin antagonist | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1998-05-19 | — | — | US | disclosed |