Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL28380698 | 0.87 | ALDH1A1 (0.45) | ALDH1A1HPGDENPP2FFAR1FFAR4 | |
| SCHEMBL8855696 | 0.83 | TSHR (0.46) | TSHRNISCHALDH1A1LRRK2CYP19A1 | |
| SCHEMBL11967122 | 0.82 | TSHR (0.45) | TSHRNISCHALDH1A1LRRK2MAOB | |
| SCHEMBL6354890 | 0.80 | TSHR (0.43) | TSHRNISCHALDH1A1LRRK2CYP19A1 | |
| SCHEMBL15898401 | 0.80 | TSHR (0.43) | TSHRNISCHALDH1A1LRRK2CYP19A1 | |
| Water SCHEMBL8703021 | 0.80 | TSHR (0.43) | TSHRNISCHALDH1A1LRRK2CYP19A1 | |
| SCHEMBL2134106 | 0.80 | PDCD1 (0.48) | TSHRNISCHALDH1A1LRRK2SMN1; SMN2 | |
| SCHEMBL31667703 | 0.80 | TSHR (0.43) | TSHRNISCHALDH1A1LRRK2CYP19A1 | |
| SCHEMBL8700310 | 0.80 | TSHR (0.43) | TSHRNISCHALDH1A1LRRK2CYP19A1 | |
| SCHEMBL3792645 | 0.79 | ESR1 (0.41) | TSHRALDH1A1HPGDENPP2SMN1; SMN2 |
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-2044037-A2 | HIV REVERSE TRANSCRIPTASE INHIBITORS | Gilead Sciences, Inc. (US) | 2009-04-08 | — | — | EP | disclosed |
| WO-2008016522-A2 | HIV REVERSE TRANSCRIPTASE INHIBITORS | GILEAD SCIENCES, INC. (US) | 2008-02-07 | — | — | WO | disclosed |