Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 2/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.41 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.39 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.38 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20699744 | 1.00 | GABRG2 (0.41) | GABRG2GABRB3GABRA5CACNA1BGABRA1 | |
| SCHEMBL19211697 | 0.84 | AKR1C3 (0.35) | MAPTAKR1C3AKR1C2PTGDR2PGR | |
| SCHEMBL31370553 | 0.82 | GABRG2 (0.42) | GABRG2GABRB3GABRA5GABRA1GABRA2 | |
| SCHEMBL20699701 | 0.81 | GABRG2 (0.39) | GABRG2GABRB3GABRA5CACNA1BGABRA1 | |
| SCHEMBL31370521 | 0.81 | KDM4E (0.43) | MAPTAKR1C3AKR1C2 | |
| SCHEMBL716282 | 0.79 | CHRM2 (0.48) | CCNB2CDK1CCNB1GSK3BCCNB3 | |
| SCHEMBL29374715 | 0.79 | CHRM2 (0.48) | CCNB2CDK1CCNB1GSK3BCCNB3 | |
| SCHEMBL19255038 | 0.77 | CA12 (0.41) | GABRG2GABRB3GABRA5CACNA1BMAPT | |
| SCHEMBL19785401 | 0.77 | GABRG2 (0.52) | GABRG2GABRB3GABRA5CACNA1BGABRA1 | |
| SCHEMBL20699719 | 0.76 | CACNA1B (0.37) | GABRG2GABRB3GABRA5CACNA1BGABRA1 |
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-109153642-B | Indole and azaindole halogenated allylamine derivative inhibitors of lysyl oxidase and uses thereof | 法玛西斯有限公司 | 2022-05-17 | — | — | CN | disclosed |