Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 2/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 7/20 | 0.42 |
| ▸ | DAPK1 | P53355 | 1/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.40 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5796113 | 0.92 | ALDH1A1 (0.43) | MCL1KDM4EALDH1A1HPGDMEN1 | |
| SCHEMBL5807117 | 0.92 | P2RX3 (0.49) | PIN1MCL1KDM4EALDH1A1HPGD | |
| SCHEMBL5807110 | 0.92 | P2RX3 (0.49) | PIN1MCL1KDM4EALDH1A1HPGD | |
| SCHEMBL5796112 | 0.92 | ALDH1A1 (0.43) | MCL1KDM4EALDH1A1HPGDMEN1 | |
| SCHEMBL5797682 | 0.90 | GCGR (0.46) | PIN1DAPK1PIM3KDM4EALDH1A1 | |
| SCHEMBL5813652 | 0.90 | MEN1 (0.50) | PIN1MCL1DAPK1PIM3KDM4E | |
| SCHEMBL5812472 | 0.86 | NPC1 (0.40) | PIN1MCL1DAPK1PIM3KDM4E | |
| SCHEMBL5824029 | 0.85 | ALDH1A1 (0.45) | DAPK1PIM3KDM4EALDH1A1HPGD | |
| SCHEMBL5795607 | 0.85 | P2RX3 (0.51) | PIN1DAPK1PIM3KDM4EALDH1A1 | |
| SCHEMBL5795610 | 0.85 | P2RX3 (0.51) | PIN1DAPK1PIM3KDM4EALDH1A1 |
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-2006025683-A1 | ARYLAMINOMETHYL PROPENYL BENZHYDROXYAMID DERIVATIVES WITH INHIBITORY ACTIVITY AGAINST HISTONE DEACETYLASE AND METHOD FOR THE PREPARATION THEREOF | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2006-03-09 | — | — | WO | disclosed |