Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.37 |
| ▸ | ZDHHC20 | Q5W0Z9 | 3/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ZDHHC2 | Q9UIJ5 | 2/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.31 |
| ▸ | NAAA | Q02083 | 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 | |
|---|---|---|---|---|
| SCHEMBL5147576 | 0.99 | TSHR (0.45) | TSHRHPGDALDH1A1CYP3A4HCAR2 | |
| Methacrylic Acid SCHEMBL15733333 | 0.84 | TSHR (0.58) | TSHRHPGDALDH1A1CYP3A4HCAR2 | |
| Methacrylic Acid SCHEMBL28214417 | 0.84 | TSHR (0.58) | TSHRHPGDALDH1A1CYP3A4HCAR2 | |
| SCHEMBL668356 | 0.84 | TSHR (0.65) | TSHRHPGDALDH1A1CYP3A4HCAR2 | |
| SCHEMBL29919002 | 0.83 | TSHR (0.54) | TSHRHPGDALDH1A1CYP3A4HCAR2 | |
| SCHEMBL4790718 | 0.83 | TSHR (0.54) | TSHRHPGDALDH1A1CYP3A4HCAR2 | |
| Itaconate SCHEMBL11349099 | 0.83 | TSHR (0.51) | TSHRHPGDALDH1A1CYP3A4HCAR2 | |
| SCHEMBL8958812 | 0.83 | TSHR (0.63) | TSHRHPGDALDH1A1CYP3A4HCAR2 | |
| SCHEMBL7974959 | 0.83 | TSHR (0.63) | TSHRHPGDALDH1A1CYP3A4HCAR2 | |
| SCHEMBL8349812 | 0.83 | TSHR (0.63) | TSHRHPGDALDH1A1CYP3A4HCAR2 |
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-2000054039-A1 | SELECTIVE POLYMER MATERIAL | HALL ELIZABETH ANNE HOWLETT (GB) | 2000-09-14 | — | — | WO | disclosed |