Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 4/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | MMP13 | P45452 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.44 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 4/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL13680452 | 0.80 | GSK3B (0.61) | HPGDSMN1; SMN2MEN1ALDH1A1MAPT | |
| SCHEMBL13680465 | 0.80 | GSK3B (0.61) | HPGDSMN1; SMN2MEN1ALDH1A1MAPT | |
| SCHEMBL5655892 | 0.79 | GSK3B (0.64) | HPGDHTTSMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL13680707 | 0.79 | MAPT (0.40) | HPGDHTTSMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL13680503 | 0.79 | GSK3B (0.62) | HPGDSMN1; SMN2ALDH1A1KDM4ELMNA | |
| SCHEMBL13680510 | 0.77 | ALDH1A1 (0.52) | MMP13HPGDSMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL16198923 | 0.77 | HDAC6 (0.70) | PLK1HDAC6HDAC2HDAC8MMP13 | |
| SCHEMBL14115137 | 0.77 | HDAC6 (0.70) | PLK1HDAC6HDAC2HDAC8MMP13 | |
| SCHEMBL23197679 | 0.77 | TDP1 (0.56) | HPGDSMN1; SMN2MEN1ALDH1A1MAPT | |
| SCHEMBL13680494 | 0.76 | ALDH1A1 (0.46) | HPGDSMN1; SMN2MEN1ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |