Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.44 |
| ▸ | ERN1 | O75460 | 1/20 | 0.42 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.41 |
| ▸ | FBP1 | P09467 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | SLC25A1 | P53007 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28410825 | 1.00 | CA1 (0.47) | CA1CA2GPR35ERN1VCAM1 | |
| SCHEMBL4068107 | 0.82 | CA1 (0.50) | CA1CA2GPR35VCAM1FBP1 | |
| SCHEMBL31057272 | 0.81 | PKM (0.42) | ERN1VCAM1TDP1MAPK1ALDH1A1 | |
| SCHEMBL9737315 | 0.81 | CA1 (0.67) | CA1CA2GPR35VCAM1TDP1 | |
| SCHEMBL21749931 | 0.81 | GPR35 (0.52) | CA1CA2GPR35ERN1FBP1 | |
| SCHEMBL2894909 | 0.81 | CASP6 (0.53) | CA1CA2VCAM1CASP6TSHR | |
| SCHEMBL11800391 | 0.79 | TDP1 (0.56) | CA1CA2GPR35ERN1FBP1 | |
| SCHEMBL16636901 | 0.79 | CA1 (0.47) | CA1CA2GPR35ERN1FBP1 | |
| SCHEMBL25863193 | 0.79 | LMNA (0.47) | CA1CA2GPR35ERN1FBP1 | |
| SCHEMBL5781652 | 0.79 | DPP4 (0.43) | GPR35TSHRMAPK1ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-118488944-A | Nitrogen-containing heterocyclic compound having Nrf2 activation | 中外制药株式会社 | 2024-08-13 | — | — | CN | disclosed |