Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 3/20 | 0.96 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.96 |
| ▸ | MAOB | P27338 | 2/20 | 0.96 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.96 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.96 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.96 |
| ▸ | BACE1 | P56817 | 14/20 | 0.71 |
| ▸ | TYR | P14679 | 3/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.65 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.65 |
| ▸ | F3 | P13726 | 1/20 | 0.65 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.65 |
| ▸ | CA12 | O43570 | 2/20 | 0.63 |
| ▸ | CA1 | P00915 | 2/20 | 0.63 |
| ▸ | CA2 | P00918 | 2/20 | 0.63 |
| ▸ | CA7 | P43166 | 2/20 | 0.63 |
| ▸ | CA9 | Q16790 | 2/20 | 0.63 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.63 |
| ▸ | ESR1 | P03372 | 1/20 | 0.63 |
| ▸ | CA3 | P07451 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| Bisdemethoxycurcumin SCHEMBL2574140 | 0.98 | AKR1B1 (1.00) | AKR1B1AKR1B10MAOBPTGS2GLO1 | |
| Bisdemethoxycurcumin SCHEMBL428638 | 0.98 | AKR1B1 (1.00) | AKR1B1AKR1B10MAOBPTGS2GLO1 | |
| SCHEMBL16702807 | 0.90 | AKR1B1 (0.85) | AKR1B1AKR1B10MAOBPTGS2GLO1 | |
| SCHEMBL16702808 | 0.90 | AKR1B1 (0.85) | AKR1B1AKR1B10MAOBPTGS2GLO1 | |
| SCHEMBL23728364 | 0.88 | AKR1B1 (0.81) | AKR1B1AKR1B10MAOBPTGS2GLO1 | |
| SCHEMBL12469737 | 0.88 | AKR1B1 (0.81) | AKR1B1AKR1B10MAOBPTGS2GLO1 | |
| SCHEMBL1646481 | 0.88 | AKR1B1 (0.81) | AKR1B1AKR1B10MAOBPTGS2GLO1 | |
| SCHEMBL1646483 | 0.88 | AKR1B1 (0.81) | AKR1B1AKR1B10MAOBPTGS2GLO1 | |
| SCHEMBL12469736 | 0.88 | AKR1B1 (0.81) | AKR1B1AKR1B10MAOBPTGS2GLO1 | |
| SCHEMBL3211832 | 0.88 | MAOB (0.81) | AKR1B1AKR1B10MAOBPTGS2GLO1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106987566-B | Type III polyketide synthase and its encoding gene and purposes | 北京中医药大学 | 2019-10-15 | — | — | CN | disclosed |
| CN-106987566-A | Type III polyketide synthase and its encoding gene and purposes | 北京中医药大学 | 2017-07-28 | — | — | CN | disclosed |