Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | DAO | P14920 | 3/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | SPR | P35270 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 3/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.34 |
| ▸ | DDO | Q99489 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24602620 | 0.80 | TSHR (0.47) | TSHRHSD17B10ALDH1A1HPGDCYP3A4 | |
| SCHEMBL6053398 | 0.80 | HSD17B10 (0.72) | TSHRHSD17B10ALDH1A1HPGDCYP3A4 | |
| SCHEMBL29970978 | 0.79 | TSHR (0.44) | TSHRHSD17B10ALDH1A1HPGDCYP3A4 | |
| SCHEMBL1156294 | 0.79 | CA9 (0.44) | TSHRHSD17B10ALDH1A1HPGDCYP3A4 | |
| SCHEMBL26607169 | 0.75 | TSHR (0.41) | TSHRHSD17B10ALDH1A1HPGDCYP3A4 | |
| SCHEMBL25085814 | 0.75 | TSHR (0.41) | TSHRHSD17B10ALDH1A1HPGDCYP3A4 | |
| SCHEMBL19914268 | 0.75 | ALDH1A1 (0.41) | TSHRHSD17B10ALDH1A1HPGDCYP3A4 | |
| SCHEMBL25205090 | 0.75 | HSD17B10 (0.41) | TSHRHSD17B10ALDH1A1HPGDCYP3A4 | |
| SCHEMBL1418178 | 0.75 | TSHR (0.50) | TSHRHSD17B10ALDH1A1HPGDCYP3A4 | |
| SCHEMBL11712559 | 0.74 | HSD17B10 (0.40) | TSHRHSD17B10ALDH1A1HPGDCYP3A4 |
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-2016059242-A2 | TRACERS | INSTITUTT FOR ENERGITEKNIKK (NO) | 2016-04-21 | — | — | WO | disclosed |