Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.41 |
| ▸ | IDO1 | P14902 | 4/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | LTK | P29376 | 1/20 | 0.40 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29349851 | 0.86 | CA12 (0.54) | TTRCYP1A2IDO1CA12CA3 | |
| SCHEMBL6254 | 0.86 | CA12 (0.54) | TTRCYP1A2IDO1CA12CA3 | |
| SCHEMBL3384278 | 0.85 | CA12 (0.53) | TTRCYP1A2IDO1CA12CA3 | |
| Hydrochloric Acid SCHEMBL14833086 | 0.85 | TSHR (0.55) | TTRCYP1A2IDO1CA12CA3 | |
| SCHEMBL3384286 | 0.85 | CA12 (0.53) | TTRCYP1A2IDO1CA12CA3 | |
| Water SCHEMBL30987561 | 0.83 | CA12 (0.51) | TTRCYP1A2IDO1CA12CA3 | |
| Water SCHEMBL29222618 | 0.83 | CA12 (0.51) | TTRCYP1A2IDO1CA12CA3 | |
| Edetic Acid SCHEMBL8199947 | 0.82 | CA1 (0.48) | TTRCYP1A2IDO1CA12CA3 | |
| Isothiocyanate SCHEMBL8518639 | 0.79 | CA12 (0.47) | TTRCYP1A2IDO1CA12CA3 | |
| SCHEMBL22793508 | 0.78 | TTR (0.43) | TTRCYP1A2IDO1CA12CA3 |
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-2023095406-A1 | ALKALINE WATER ELECTROLYSIS METHOD, AND ANODE FOR ALKALINE WATER ELECTROLYSIS | デノラ・ペルメレック株式会社 | 2023-06-01 | — | — | WO | disclosed |