Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.50 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | MAOB | P27338 | 3/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | P4HB | P07237 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6769123 | 1.00 | HDAC1 (0.50) | HDAC1HDAC6HDAC3HDAC4HDAC2 | |
| SCHEMBL6770058 | 0.90 | HDAC3 (0.48) | HDAC1HDAC6HDAC3HDAC4HDAC2 | |
| SCHEMBL6770057 | 0.90 | HDAC3 (0.48) | HDAC1HDAC6HDAC3HDAC4HDAC2 | |
| SCHEMBL6770202 | 0.83 | HDAC1 (0.42) | HDAC1HDAC6HDAC3HDAC4HDAC2 | |
| SCHEMBL6770199 | 0.83 | HDAC1 (0.42) | HDAC1HDAC6HDAC3HDAC4HDAC2 | |
| SCHEMBL6765905 | 0.83 | TP53 (0.45) | HDAC1HDAC6MAPTP4HBCYP1B1 | |
| SCHEMBL6765901 | 0.81 | CYP1B1 (0.44) | ESR1ESR2MAPTMAOBMAOA | |
| SCHEMBL6765906 | 0.81 | CYP1B1 (0.44) | ESR1ESR2MAPTMAOBMAOA | |
| SCHEMBL5736954 | 0.77 | HDAC1 (0.47) | HDAC1HDAC6HDAC3HDAC4HDAC2 | |
| SCHEMBL6770006 | 0.76 | HDAC1 (0.56) | HDAC1HDAC6HDAC3HDAC4HDAC2 |
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-6683092-B1 | BREAST AND/OR PROSTATE CANCER | ALLERGAN, INC. | 2004-01-27 | — | — | US | disclosed |