Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 6/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10939397 | 0.79 | ALDH1A1 (0.58) | PKMALDH1A1MAPTHTTPOLB | |
| SCHEMBL5537011 | 0.76 | ALDH1A1 (0.56) | PKMALDH1A1CREBBPMAPTPOLB | |
| SCHEMBL1928760 | 0.76 | — | — | |
| SCHEMBL31265782 | 0.74 | PKM (0.61) | PKMALDH1A1CREBBPMAPTALOX15 | |
| SCHEMBL31138131 | 0.74 | ALDH1A1 (0.49) | PKMALDH1A1MAPTHTTATM | |
| SCHEMBL22568972 | 0.74 | HTT (0.54) | ALDH1A1CREBBPMAPTALOX15HTT | |
| SCHEMBL10936334 | 0.73 | ALDH1A1 (0.57) | PKMALDH1A1MAPTHTTTDP1 | |
| SCHEMBL2419793 | 0.72 | ALDH1A1 (0.68) | PKMALDH1A1MAPTHTTPOLB | |
| SCHEMBL9772746 | 0.71 | PKM (0.58) | PKMALDH1A1CREBBPMAPTTDP1 | |
| SCHEMBL11003325 | 0.70 | MAP2K1 (0.53) | ALDH1A1MAPTALOX15HTTPOLB |
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-1042539-C | 11,21-bisphenyl-19-norpregnane derivatives | AKZO NOBEL NV (NL) | 1999-03-17 | — | — | CN | disclosed |