Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 4/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.55 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.55 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.49 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | APEX1 | P27695 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.45 |
| ▸ | KLK1 | P06870 | 1/20 | 0.45 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1320296 | 0.85 | HDAC2 (0.50) | HDAC2HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL8525436 | 0.85 | HDAC2 (0.50) | HDAC2HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL8525574 | 0.84 | AKR1B1 (0.48) | HDAC2HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL8524189 | 0.81 | AKR1B1 (0.48) | HDAC2HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL8525059 | 0.81 | HDAC2 (0.46) | HDAC2HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL18132545 | 0.78 | APEX1 (0.77) | HDAC7EPHX2AKR1B1APEX1MAOA | |
| SCHEMBL20764583 | 0.77 | EPHX2 (0.72) | HDAC2HDAC1HDAC8HDAC6NR1H4 | |
| SCHEMBL8524730 | 0.76 | CA12 (0.42) | HDAC2HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL1110102 | 0.75 | TUBB (0.46) | HDAC2HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL8489621 | 0.74 | EGLN1 (0.46) | HDAC2HDAC1HDAC3HDAC4HDAC7 |
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-1999029670-A2 | AMINOCARBONYLTETRALIN AND DIHYDRONAPHTALENE DERIVATES AS THROMBIN INHIBITORS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-06-17 | — | — | WO | disclosed |