Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | ORAI1 | Q96D31 | 2/20 | 0.42 |
| ▸ | ORAI2 | Q96SN7 | 2/20 | 0.42 |
| ▸ | ORAI3 | Q9BRQ5 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL28994175 | 0.82 | TSHR (0.43) | TSHRACHEORAI1ORAI2ORAI3 | |
| SCHEMBL8166597 | 0.77 | TRPV6 (0.34) | TSHRORAI1ORAI2ORAI3TRPV6 | |
| SCHEMBL7463344 | 0.77 | TSHR (0.38) | TSHRACHECA1CA2CA7 | |
| SCHEMBL28994183 | 0.77 | TSHR (0.38) | TSHRACHECA1CA2CA7 | |
| SCHEMBL11593372 | 0.76 | TSHR (0.47) | TSHRACHECA1CA2CA7 | |
| SCHEMBL7930396 | 0.75 | ENPP2 (0.41) | TSHRACHEORAI1ORAI2ORAI3 | |
| SCHEMBL126881 | 0.75 | TSHR (0.53) | TSHRACHECA1CA2CA7 | |
| Ammonia Solution, Strong SCHEMBL11227356 | 0.72 | TSHR (0.50) | TSHRACHECA1CA2CA7 | |
| SCHEMBL187525 | 0.72 | TSHR (0.50) | TSHRACHECA1CA2CA7 | |
| SCHEMBL21318192 | 0.72 | TSHR (0.50) | TSHRACHECA1CA2CA7 |
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-1003753-B1 | COMPOUNDS CONTAINING BORON AND ALUMINIUM | BASELL POLYOLEFINE GMBH (DE) | 2003-03-05 | — | — | EP | disclosed |
| US-6417302-B1 | REACTION PRODUCT OF DI(PENTAFLUOROPHENYL) BORINIC ACID AND ORGANOALUMINUM COMPOUND; OLEFIN POLYMERIZATION COORDINATION CATALYSTS | BASELL POLYOLEFINE GMBH (DE) | 2002-07-09 | — | — | US | disclosed |