Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | ALB | P02768 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | HNF4A | P41235 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2747847 | 0.83 | CYP1A2 (0.67) | HPGDALDH1A1HSD17B10CYP1A2POLB | |
| SCHEMBL1830472 | 0.82 | POLB (0.49) | HPGDALDH1A1HSD17B10ALBCYP1A2 | |
| SCHEMBL27998062 | 0.81 | CYP1A2 (0.65) | HPGDALDH1A1HSD17B10CYP1A2POLB | |
| SCHEMBL28728287 | 0.81 | CYP1A2 (0.65) | HPGDALDH1A1HSD17B10CYP1A2POLB | |
| Hydrochloric Acid SCHEMBL9952241 | 0.81 | CYP1A2 (0.65) | HPGDALDH1A1HSD17B10CYP1A2POLB | |
| SCHEMBL201556 | 0.80 | GABRA1 (0.48) | HPGDALDH1A1HSD17B10MITFLMNA | |
| SCHEMBL4853402 | 0.80 | CYP1A2 (0.62) | HPGDALDH1A1HSD17B10CYP1A2POLB | |
| SCHEMBL2960122 | 0.79 | ALDH1A1 (0.57) | HPGDALDH1A1HSD17B10ALBKDM4E | |
| SCHEMBL144896 | 0.79 | POLB (0.65) | HPGDALDH1A1HSD17B10ALBKDM4E | |
| SCHEMBL29176412 | 0.78 | ALDH1A1 (0.51) | HPGDALDH1A1HSD17B10KDM4ECYP1A2 |
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-1991005605-A1 | CYCLODEXTRIN LABELS FOR IMMUNOASSAY AND BIOCHEMICAL ANALYSIS | KOSAK KENNETH M (US) | 1991-05-02 | — | — | WO | disclosed |