Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CD44 | P16070 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1755243 | 0.71 | HSD17B10 (0.60) | HSD17B10TSHRACHEALDH1A1MAPT | |
| O-Xylene SCHEMBL8994552 | 0.66 | TSHR (0.67) | TSHRACHEALDH1A1SMN1; SMN2TDP1 | |
| O-Xylene SCHEMBL15875996 | 0.65 | TSHR (0.77) | TSHRACHEALDH1A1SMN1; SMN2TDP1 | |
| SCHEMBL9247778 | 0.64 | TSHR (0.53) | HSD17B10TSHRACHEALDH1A1MAPT | |
| Lithium Ion SCHEMBL7630172 | 0.62 | TSHR (0.50) | HSD17B10TSHRACHEALDH1A1MAPT | |
| Silver SCHEMBL7630794 | 0.62 | TSHR (0.50) | HSD17B10TSHRACHEALDH1A1MAPT | |
| SCHEMBL11227424 | 0.62 | HSD17B10 (0.60) | HSD17B10TSHRACHEALDH1A1MAPT | |
| SCHEMBL26788 | 0.62 | HSD17B10 (1.00) | HSD17B10TSHRALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL5700792 | 0.62 | HSD17B10 (0.60) | HSD17B10TSHRACHEALDH1A1MAPT | |
| SCHEMBL8008054 | 0.62 | HSD17B10 (0.60) | HSD17B10TSHRACHEALDH1A1MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009147170-A2 | DRUG COMBINATIONS COMPRISING A DGAT INHIBITOR AND A PPAR-AGONIST | JANSSEN PHARMACEUTICA NV (BE) | 2009-12-10 | — | — | WO | disclosed |