Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 3/20 | 0.76 |
| ▸ | MAOB | P27338 | 2/20 | 0.76 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.76 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.76 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.76 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.76 |
| ▸ | BACE1 | P56817 | 9/20 | 0.74 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.68 |
| ▸ | MAOA | P21397 | 1/20 | 0.68 |
| ▸ | IAPP | P10997 | 3/20 | 0.68 |
| ▸ | LCK | P06239 | 1/20 | 0.67 |
| ▸ | NQO2 | P16083 | 1/20 | 0.67 |
| ▸ | MMP1 | P03956 | 2/20 | 0.65 |
| ▸ | MMP2 | P08253 | 2/20 | 0.65 |
| ▸ | MMP9 | P14780 | 2/20 | 0.65 |
| ▸ | XDH | P47989 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.61 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL3671201 | 1.00 | AKR1B1 (0.76) | AKR1B1MAOBAKR1B10PTGS2GLO1 | |
| SCHEMBL3671196 | 1.00 | AKR1B1 (0.76) | AKR1B1MAOBAKR1B10PTGS2GLO1 | |
| Didemethylcurcumin SCHEMBL613666 | 0.93 | IAPP (0.77) | AKR1B1MAOBAKR1B10PTGS2GLO1 | |
| Didemethylcurcumin SCHEMBL613667 | 0.93 | IAPP (0.77) | AKR1B1MAOBAKR1B10PTGS2GLO1 | |
| Bisdemethoxycurcumin SCHEMBL428638 | 0.87 | AKR1B1 (1.00) | AKR1B1MAOBAKR1B10PTGS2GLO1 | |
| Bisdemethoxycurcumin SCHEMBL2574140 | 0.87 | AKR1B1 (1.00) | AKR1B1MAOBAKR1B10PTGS2GLO1 | |
| SCHEMBL10021657 | 0.86 | CYP2C9 (0.74) | AKR1B1AKR1B10BACE1IAPPLCK | |
| SCHEMBL3214875 | 0.85 | AKR1B1 (0.69) | AKR1B1MAOBAKR1B10PTGS2GLO1 | |
| SCHEMBL3221692 | 0.85 | BACE1 (1.00) | AKR1B1MAOBAKR1B10PTGS2GLO1 | |
| SCHEMBL3214862 | 0.85 | AKR1B1 (0.69) | AKR1B1MAOBAKR1B10PTGS2GLO1 |
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-2022090877-A1 | METAL COMPLEXES OF DIARYLHEPTANOIDS AND ITS DERIVATIVES | ARJUNA NATURAL PRIVATE LIMITED (IN) | 2022-05-05 | — | — | WO | disclosed |