Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 2/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | EIF4E | P06730 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.36 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15089700 | 0.86 | S100A4 (0.47) | S100A4TRPV1SRD5A1SRD5A2MAPT | |
| SCHEMBL15066645 | 0.80 | ALDH1A1 (0.58) | S100A4SRD5A1SRD5A2MAPTADORA1 | |
| SCHEMBL26205134 | 0.78 | S100A4 (0.56) | S100A4TRPV1GABRA1GABRG2GABRB3 | |
| SCHEMBL28573343 | 0.78 | S100A4 (0.46) | S100A4TRPV1MAPTGABRA1GABRG2 | |
| SCHEMBL13828623 | 0.76 | CYP2A6 (0.47) | S100A4TRPV1MAPTGABRA1GABRG2 | |
| SCHEMBL15790413 | 0.76 | ALDH1A1 (0.61) | S100A4TRPV1GABRA1GABRG2GABRB3 | |
| SCHEMBL15562833 | 0.74 | AHR (0.53) | S100A4TRPV1GABRA1GABRG2GABRB3 | |
| SCHEMBL2374386 | 0.74 | S100A4 (0.57) | S100A4TRPV1SRD5A1SRD5A2MAPT | |
| SCHEMBL14906924 | 0.73 | S100A4 (0.56) | S100A4TRPV1MAPTGABRA1GABRG2 | |
| SCHEMBL30638948 | 0.73 | ALDH1A1 (0.45) | S100A4TRPV1MAPTGABRA1GABRG2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013100507-A1 | NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING SAME | 주식회사 두산 (KR) | 2013-07-04 | — | — | WO | disclosed |
| WO-2013100507-A1 | NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING SAME | 주식회사 두산 (KR) | 2013-07-04 | — | — | WO | disclosed |