Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TYR | P14679 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8007165 | 1.00 | ALOX15 (0.38) | ALOX15HSD17B10ALDH1A1HPGDGAA | |
| SCHEMBL78524 | 0.79 | TSHR (0.46) | ALOX15HSD17B10ALDH1A1HPGDGAA | |
| SCHEMBL31289548 | 0.75 | ALOX15 (0.45) | ALOX15HSD17B10ALDH1A1HPGDGAA | |
| SCHEMBL11156077 | 0.74 | APP (0.44) | ALOX15HSD17B10ALDH1A1HPGDGAA | |
| SCHEMBL9872565 | 0.74 | ADRB2 (0.41) | ALOX15HSD17B10ALDH1A1HPGDGAA | |
| SCHEMBL14003938 | 0.74 | GSTP1 (0.37) | ALDH1A1HPGDPKMTYRMAPT | |
| SCHEMBL5316260 | 0.72 | MAOA (0.42) | HSD17B10ALDH1A1LMNAESR1CA12 | |
| SCHEMBL14003922 | 0.72 | CA12 (0.48) | ALDH1A1GAALMNAESR1CA12 | |
| SCHEMBL13805530 | 0.72 | CA12 (0.48) | ALDH1A1GAALMNAESR1CA12 | |
| SCHEMBL8720681 | 0.70 | ESR1 (0.40) | ALOX15HSD17B10ALDH1A1HPGDGAA |
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-2016135037-A1 | DIANHYDROHEXITOL CODRUG | NITTO DENKO CORPORATION (JP) | 2016-09-01 | — | — | WO | disclosed |
| US-6156866-A | Chiral nematic polycarbonates | BASF AKTIENGESELLSCHAFT (DE) | 2000-12-05 | — | — | US | disclosed |