Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7068463 | 0.98 | TSHR (0.48) | TSHRHTR2CCA12CA1CA2 | |
| SCHEMBL12656121 | 0.96 | TSHR (0.52) | TSHRHTR2CCA12CA1CA2 | |
| SCHEMBL10033122 | 0.91 | — | — | |
| SCHEMBL18972967 | 0.81 | — | — | |
| SCHEMBL7486715 | 0.77 | TSHR (0.50) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL13176832 | 0.77 | TSHR (0.50) | TSHRHTR2CCA12CA1CA2 | |
| SCHEMBL12624782 | 0.77 | NAAA (0.56) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL16382184 | 0.77 | NAAA (0.56) | TSHRCA12CA1CA2CA9 | |
| SCHEMBL13176716 | 0.77 | TSHR (0.50) | TSHRHTR2CCA12CA1CA2 | |
| SCHEMBL7486705 | 0.76 | TSHR (0.53) | TSHRCA12CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| JP-3246262-A | — | — | None | — | — | JP | disclosed |
| JP-H03246262-A | PRODUCTION OF 2-ACYLOXY-1,1,2,3,3-PENTAHYDROPERFLUORO-ALKYLAMINE N-TYPE BETAINE | E I DU PONT DE NEMOURS & CO | 1991-11-01 | — | — | JP | disclosed |