Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.32 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | VNN1 | O95497 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15170636 | 0.82 | POLB (0.35) | HDAC3HDAC1HDAC2HDAC6POLB | |
| SCHEMBL9751446 | 0.81 | NUDT1 (0.37) | HDAC3HDAC1HDAC2HDAC6CYP1A2 | |
| SCHEMBL21025398 | 0.76 | BRS3 (0.37) | HDAC3HDAC1HDAC2HDAC6CYP1A2 | |
| SCHEMBL8125836 | 0.74 | HDAC3 (0.34) | HDAC3HDAC1HDAC2HDAC6CYP1A2 | |
| SCHEMBL14003761 | 0.73 | HRH3 (0.36) | HDAC3HDAC1HDAC2HDAC6CYP1A2 | |
| SCHEMBL27967981 | 0.71 | ADORA3 (0.38) | HDAC3HDAC1HDAC2HDAC6CYP1A2 | |
| SCHEMBL21740803 | 0.70 | KDM4E (0.41) | HDAC3HDAC1HDAC2HDAC6XDH | |
| SCHEMBL29530008 | 0.70 | — | — | |
| SCHEMBL30390174 | 0.70 | — | — | |
| SCHEMBL839885 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015054452-A1 | KERATIN CONDITIONING BIO-BASED POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS | BASF SE (DE) | 2015-04-16 | — | — | WO | disclosed |