Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 5/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.49 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11701595 | 0.96 | AKR1B1 (0.51) | AKR1B1CYP1A2MAPK14HDAC3MAPK1 | |
| SCHEMBL11706524 | 0.95 | MAPT (0.51) | AKR1B1CYP1A2MAPK14HDAC3MAPK1 | |
| SCHEMBL503763 | 0.93 | CYP1A2 (0.55) | AKR1B1CYP1A2HDAC3MAPK1ADRA1A | |
| SCHEMBL24440105 | 0.83 | CYP1A2 (0.56) | CYP1A2HDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL11088738 | 0.83 | AKR1B1 (0.74) | AKR1B1MAPK14SRD5A1SRD5A2CES1 | |
| SCHEMBL11705908 | 0.81 | MAPK14 (0.46) | AKR1B1MAPK14MAPK1SMN1; SMN2SRD5A1 | |
| SCHEMBL11197534 | 0.81 | AKR1B1 (0.60) | AKR1B1 | |
| SCHEMBL11706674 | 0.80 | MAPK14 (0.45) | AKR1B1MAPK14SRD5A1SRD5A2 | |
| SCHEMBL11700580 | 0.79 | MAPK14 (0.44) | AKR1B1MAPK14 | |
| SCHEMBL9133025 | 0.79 | PDK2 (0.53) | AKR1B1FFAR4SRD5A1SRD5A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4038299-A | ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC | SYNTEX (U.S.A.) INC. (US) | 1977-07-26 | — | — | US | disclosed |
| US-3966820-A | ANALGESICS, ANTIINFLAMMATORY, ANTIPYRETICS | SYNTEX (U.S.A.) INC. (US) | 1976-06-29 | — | — | US | disclosed |