Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B10 | O60218 | 2/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25853442 | 0.85 | RAB9A (0.45) | CYP1A2TSHRHDAC3HDAC4HDAC1 | |
| SCHEMBL25853430 | 0.84 | HDAC3 (0.44) | CYP1A2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL25853432 | 0.84 | HDAC3 (0.44) | CYP1A2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL15428801 | 0.83 | CA12 (0.57) | AKR1B10AKR1B1CA12CA1CA2 | |
| SCHEMBL25299710 | 0.77 | MMP1 (0.47) | AKR1B1CYP1A2HDAC3HDAC4HDAC1 | |
| SCHEMBL5082817 | 0.77 | KMT2A (0.54) | AKR1B10AKR1B1CA12CA1CA2 | |
| SCHEMBL25299709 | 0.77 | MMP1 (0.47) | AKR1B1CYP1A2HDAC3HDAC4HDAC1 | |
| SCHEMBL5082816 | 0.77 | KMT2A (0.54) | AKR1B10AKR1B1CA12CA1CA2 | |
| SCHEMBL14356149 | 0.75 | MEN1 (0.49) | AKR1B10AKR1B1CA12CA1CA2 | |
| SCHEMBL15163756 | 0.75 | MEN1 (0.49) | AKR1B10AKR1B1CA12CA1CA2 |
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-2023131362-A1 | PHENYLPROPANOID DERIVATIVES | USTAV EXPERIMENTALNI BOTANIKY AV ČR, V. V. I. (CZ) | 2023-07-13 | — | — | WO | disclosed |