Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 4/20 | 0.57 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.57 |
| ▸ | ERN1 | O75460 | 3/20 | 0.50 |
| ▸ | TYR | P14679 | 1/20 | 0.50 |
| ▸ | FABP3 | P05413 | 2/20 | 0.46 |
| ▸ | FABP4 | P15090 | 2/20 | 0.46 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3965396 | 1.00 | GABRA1 (0.57) | GABRA1GABRB2ERN1TYRFABP3 | |
| SCHEMBL20509047 | 0.82 | TYR (0.61) | GABRA1GABRB2ERN1TYRKDM4E | |
| SCHEMBL310863 | 0.81 | ERN1 (0.67) | GABRA1GABRB2ERN1TYRCA1 | |
| SCHEMBL26229436 | 0.79 | ERN1 (0.58) | GABRA1GABRB2ERN1TYRKDM4E | |
| SCHEMBL310578 | 0.79 | ERN1 (0.64) | GABRA1GABRB2ERN1TYRCA1 | |
| SCHEMBL10322298 | 0.79 | GABRA1 (0.64) | GABRA1GABRB2ERN1TYRCA1 | |
| SCHEMBL882866 | 0.79 | ERN1 (0.44) | GABRA1GABRB2ERN1TYRCA1 | |
| SCHEMBL94533 | 0.79 | GABRA1 (0.77) | GABRA1GABRB2FABP3FABP4FABP5 | |
| SCHEMBL11249537 | 0.78 | GABRA1 (0.53) | GABRA1GABRB2TYRFABP3FABP4 | |
| SCHEMBL11249533 | 0.78 | GABRA1 (0.53) | GABRA1GABRB2TYRFABP3FABP4 |
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-110862335-B | Preparation method of VEGFR2 selective inhibitor SU1498 | 安莱博医药(苏州)有限公司 | 2022-03-15 | — | — | CN | disclosed |