Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.40 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.40 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.38 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7828560 | 0.79 | GPBAR1 (0.40) | HSP90AA1PDK1PDK2PDK3PDK4 | |
| SCHEMBL9187433 | 0.79 | ALDH1A1 (0.47) | HSP90AA1PDK1PDK2PDK3PDK4 | |
| SCHEMBL9186522 | 0.79 | KDM4E (0.51) | PADI4LMNAMAPTALDH1A1KDM4E | |
| SCHEMBL6204567 | 0.76 | HDAC4 (0.49) | GPBAR1MAPTALDH1A1HDAC4 | |
| SCHEMBL7557817 | 0.76 | GPBAR1 (0.40) | GPBAR1CYP3A4CYP2C19 | |
| SCHEMBL7558468 | 0.76 | GPBAR1 (0.38) | GPBAR1MAPTKDM4E | |
| SCHEMBL6202118 | 0.75 | MEN1 (0.43) | ALDH1A1KDM4ECYP2C9 | |
| SCHEMBL7829858 | 0.74 | MAPT (0.48) | PDK2TP53MAPTALDH1A1KDM4E | |
| SCHEMBL11983220 | 0.74 | HDAC4 (0.51) | GPBAR1MAPTALDH1A1KDM4EHDAC4 | |
| SCHEMBL7818937 | 0.73 | PTGS2 (0.44) | GPBAR1MAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1224172-A1 | DRUGS FOR THE TREATMENT OF MALIGNANT TUMOURS | Active Biotech AB (SE) | 2002-07-24 | — | — | EP | claimed |
| WO-2001030758-A1 | DRUGS FOR THE TREATMENT OF MALIGNANT TUMOURS | ACTIVE BIOTECH AB (SE) | 2001-05-03 | — | — | WO | claimed |