Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | PDK1 | Q15118 | 3/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.40 |
| ▸ | PDK3 | Q15120 | 3/20 | 0.40 |
| ▸ | PDK4 | Q16654 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6986538 | 0.84 | TP53 (0.49) | TP53PDK1PDK2PDK3PDK4 | |
| SCHEMBL6978699 | 0.83 | POLB (0.48) | TP53PDK1PDK2PDK3PDK4 | |
| SCHEMBL7410530 | 0.82 | TP53 (0.45) | TP53PDK1PDK2PDK3PDK4 | |
| SCHEMBL7958782 | 0.82 | IDO1 (0.45) | ITKTP53PDK1PDK2PDK3 | |
| SCHEMBL6979177 | 0.82 | CCR5 (0.39) | ITKALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL6980414 | 0.81 | TP53 (0.44) | TP53HDAC1HDAC8HDAC6ALDH1A1 | |
| SCHEMBL6979174 | 0.81 | TP53 (0.50) | TP53HDAC1HDAC8HDAC6MEN1 | |
| SCHEMBL6981826 | 0.81 | PDK1 (0.52) | TP53PDK1PDK2PDK3PDK4 | |
| SCHEMBL6985246 | 0.81 | TP53 (0.51) | TP53PDK1PDK2PDK3PDK4 | |
| SCHEMBL7958428 | 0.80 | MEN1 (0.46) | TP53HDAC1HDAC8HDAC6ALDH1A1 |
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-6300342-B1 | FOR THERAPY OR INHIBITING THROMBUS FORMATION; FOR THERAPY OF FIBRIN-DEPENDENT INFLAMMATORY CONDITION | BOEHRINGER INGELHEIM PHARM KG (DE) | 2001-10-09 | — | — | US | disclosed |