Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 1/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.35 |
| ▸ | GABRE | P78334 | 1/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.35 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.35 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.35 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL204357 | 0.84 | S100A4 (0.61) | S100A4TRPV1GABRA1GABRG2GABRB3 | |
| SCHEMBL30577700 | 0.77 | NR4A2 (0.47) | S100A4TRPV1ALDH1A1MAPTNR4A2 | |
| SCHEMBL27814203 | 0.76 | S100A4 (0.47) | S100A4TRPV1GABRA1GABRG2GABRB3 | |
| SCHEMBL11731287 | 0.76 | GABRA1 (0.54) | S100A4TRPV1GABRA1GABRG2GABRB3 | |
| SCHEMBL14906924 | 0.75 | S100A4 (0.56) | S100A4TRPV1GABRA1GABRG2GABRB3 | |
| SCHEMBL5528175 | 0.75 | S100A4 (0.46) | S100A4TRPV1GABRA1GABRG2GABRB3 | |
| SCHEMBL5321726 | 0.74 | S100A4 (0.54) | S100A4TRPV1GABRA1GABRG2GABRB3 | |
| SCHEMBL15024965 | 0.74 | IMPDH2 (0.49) | S100A4TRPV1CYP2A6PTGES | |
| Hydrogen Sulfide SCHEMBL10764626 | 0.72 | S100A4 (0.49) | S100A4TRPV1GABRA1GABRG2GABRB3 | |
| SCHEMBL19074303 | 0.72 | TDO2 (0.49) | S100A4TRPV1MAPTPKMRAB9A |
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-104341584-A | Poly-3, 8-diindolopyrrole as well as preparation method and application thereof | UNIV SOUTH CHINA TECH | 2015-02-11 | — | — | CN | disclosed |