Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | HPRT1 | P00492 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 2/20 | 0.38 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | PRKDC | P78527 | 1/20 | 0.35 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.35 |
| ▸ | ABCG2 | Q9UNQ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL18165257 | 0.86 | ALDH1A1 (0.44) | CES1HPRT1ALDH1A1HSD17B10CYP2A6 | |
| SCHEMBL3153755 | 0.84 | ALDH1A1 (0.46) | CES1HPRT1ALDH1A1HSD17B10CYP2A6 | |
| SCHEMBL29213863 | 0.81 | ESR1 (0.46) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL7033272 | 0.77 | TRPV6 (0.39) | CES1HPRT1ALDH1A1HSD17B10CYP2A6 | |
| SCHEMBL22005379 | 0.74 | HPRT1 (0.34) | CES1HPRT1ALDH1A1HSD17B10CYP2A6 | |
| SCHEMBL3952819 | 0.71 | ALDH1A1 (0.50) | CES1HPRT1ALDH1A1HSD17B10CYP2A6 | |
| SCHEMBL7719797 | 0.71 | DNMT1 (0.46) | CES1HPRT1ALDH1A1HSD17B10CYP2A6 | |
| SCHEMBL28596672 | 0.70 | DNMT1 (0.42) | CES1HPRT1ALDH1A1HSD17B10CYP2A6 | |
| SCHEMBL29216526 | 0.69 | PTPN22 (0.52) | HPRT1ALDH1A1HSD17B10CYP2A6TSHR | |
| SCHEMBL8178839 | 0.68 | CA12 (0.58) | CYP1A2 |
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-1140947-A1 | METHOD FOR PRODUCING MONO-ORGANOBORANES OR DI-ORGANOBORANES | Basell Polyolefine GmbH (DE) | 2001-10-10 | — | — | EP | claimed |
| WO-2000037476-A1 | METHOD FOR PRODUCING MONO-ORGANOBORANES OR DI-ORGANOBORANES | BASELL POLYOLEFINE GMBH (DE) | 2000-06-29 | — | — | WO | claimed |