Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES2 | Q9H7Z7 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20856494 | 0.82 | CA1 (0.33) | ALDH1A1CA1CA2CA9 | |
| SCHEMBL24455459 | 0.76 | CES2 (0.38) | MAPTKMT2AALDH1A1MEN1PKM | |
| Hydrochloric Acid SCHEMBL20984814 | 0.74 | CES2 (0.37) | MAPTKMT2AALDH1A1MEN1PKM | |
| Hydrochloric Acid SCHEMBL30555121 | 0.74 | CES2 (0.37) | MAPTKMT2AALDH1A1MEN1PKM | |
| Bromide SCHEMBL20984571 | 0.74 | CES2 (0.37) | MAPTKMT2AALDH1A1MEN1PKM | |
| SCHEMBL1043332 | 0.74 | CES2 (0.36) | ALDH1A1CA1CA9 | |
| SCHEMBL27517888 | 0.74 | KIF11 (0.45) | PTGES2MAPTKMT2AALDH1A1MEN1 | |
| Phosphine SCHEMBL28192224 | 0.72 | CES2 (0.35) | ALDH1A1CA1CA9 | |
| Hydrogen Sulfide SCHEMBL28335379 | 0.72 | CES2 (0.35) | ALDH1A1CA1CA9 | |
| SCHEMBL1637641 | 0.69 | ALDH1A1 (0.44) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010111634-A2 | RENIN INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-09-30 | — | — | WO | disclosed |
| WO-2010111634-A2 | RENIN INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-09-30 | — | — | WO | disclosed |