Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV6 | Q9H1D0 | 5/20 | 0.48 |
| ▸ | ORAI1 | Q96D31 | 4/20 | 0.48 |
| ▸ | ORAI2 | Q96SN7 | 4/20 | 0.48 |
| ▸ | ORAI3 | Q9BRQ5 | 4/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1265686 | 1.00 | TRPV6 (0.48) | TRPV6ORAI1ORAI2ORAI3NFE2L2 | |
| SCHEMBL1265694 | 1.00 | TRPV6 (0.48) | TRPV6ORAI1ORAI2ORAI3NFE2L2 | |
| SCHEMBL125724 | 0.88 | ORAI1 (0.58) | TRPV6ORAI1ORAI2ORAI3NFE2L2 | |
| SCHEMBL500600 | 0.85 | TRPV6 (0.50) | TRPV6ORAI1ORAI2ORAI3CA7 | |
| SCHEMBL125450 | 0.82 | TRPV6 (0.53) | TRPV6ORAI1ORAI2ORAI3CA7 | |
| Pyridine SCHEMBL1173460 | 0.80 | TSHR (0.41) | TRPV6ORAI1ORAI2ORAI3NFE2L2 | |
| Phenylboronic Acid SCHEMBL28610016 | 0.79 | ENPP2 (0.70) | TRPV6ORAI1ORAI2ORAI3CA7 | |
| SCHEMBL13994379 | 0.79 | TRPV6 (0.44) | TRPV6ORAI1ORAI2ORAI3NFE2L2 | |
| SCHEMBL28610015 | 0.79 | TRPV6 (0.56) | TRPV6ORAI1ORAI2ORAI3NFE2L2 | |
| SCHEMBL991201 | 0.78 | TRPV6 (0.50) | TRPV6ORAI1ORAI2ORAI3CA7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1054914-B1 | ZWITTERIONIC, NEUTRAL TRANSITION METAL COMPOUND | BASELL POLYOLEFINE GMBH (DE) | 2004-03-03 | — | — | EP | disclosed |
| EP-1052263-A2 | Transition-metal compounds, catalyst systems, process for their preparation and use in the polymerisation of olefins | TARGOR GmbH (DE) | 2000-11-15 | — | — | EP | disclosed |