Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.37 |
| ▸ | CA2 | P00918 | 4/20 | 0.37 |
| ▸ | CA12 | O43570 | 3/20 | 0.37 |
| ▸ | CA7 | P43166 | 3/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GRIA2 | P42262 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL10680880 | 0.92 | ALDH1A1 (0.34) | CA1CA2CA12CA7CA14 | |
| SCHEMBL10678594 | 0.87 | NSD2 (0.34) | CA1CA2CA12CA7CA14 | |
| SCHEMBL10678605 | 0.87 | NSD2 (0.34) | CA1CA2CA12CA7CA14 | |
| SCHEMBL10545523 | 0.87 | CA1 (0.38) | CA1CA2CA12CA7CA14 | |
| SCHEMBL10653301 | 0.80 | IRAK4 (0.37) | CA1CA2CA12CA7CA14 | |
| SCHEMBL10649367 | 0.76 | KDM4E (0.36) | CA1CA2CA12CA7CA14 | |
| SCHEMBL10860123 | 0.75 | ACE (0.42) | KDM4EALDH1A1 | |
| SCHEMBL8895550 | 0.75 | MEN1 (0.34) | CA1CA2CA12CA7CA14 | |
| SCHEMBL11293989 | 0.74 | IRAK4 (0.36) | IRAK4KDM4EMAPTALDH1A1THRB | |
| SCHEMBL10674812 | 0.73 | PTGS1 (0.43) | CA1CA2CA12CA7CA14 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0021678-B1 | 1-SULPHO-2-OXOAZETIDINE DERIVATIVES, THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS THEREOF | Takeda Chemical Industries, Ltd. (JP) | 1984-11-07 | — | — | EP | claimed |
| JP-55164672-A | — | — | None | — | — | JP | disclosed |
| JP-S55164672-A | AZETIDINE DERIVATIVE AND ITS PREPARATION | TAKEDA CHEM IND LTD | 1980-12-22 | — | — | JP | disclosed |