Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.66 |
| ▸ | ESRRG | P62508 | 2/20 | 0.63 |
| ▸ | KDM1A | O60341 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 8/20 | 0.56 |
| ▸ | RAB9A | P51151 | 5/20 | 0.56 |
| ▸ | NPC1 | O15118 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | GAA | P10253 | 4/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | MTOR | P42345 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | MPO | P05164 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL17208798 | 0.84 | ALDH1A1 (0.57) | HPGDMAPTRAB9ANPC1ALDH1A1 | |
| SCHEMBL10930671 | 0.82 | NPC1 (0.59) | HPGDMAPTRAB9ANPC1ALDH1A1 | |
| SCHEMBL1562144 | 0.82 | NPC1 (0.72) | HPGDMAPTRAB9ANPC1ALDH1A1 | |
| SCHEMBL27177842 | 0.80 | NPC1 (0.74) | ESRRGKDM1AMAPTRAB9ANPC1 | |
| SCHEMBL27177840 | 0.80 | NPC1 (0.74) | ESRRGKDM1AMAPTRAB9ANPC1 | |
| SCHEMBL17208756 | 0.79 | PLK1 (0.59) | HPGDESRRGMAPTRAB9ANPC1 | |
| SCHEMBL2997492 | 0.78 | GAA (0.62) | MAPTRAB9ANPC1ALDH1A1GAA | |
| SCHEMBL12121702 | 0.78 | ALDH1A1 (0.45) | HPGDESRRGKDM1AMAPTRAB9A | |
| SCHEMBL12124307 | 0.78 | NPC1 (0.55) | MAPTRAB9ANPC1ALDH1A1KDM4E | |
| SCHEMBL17208749 | 0.78 | HDAC3 (0.58) | HPGDESRRGMAPTRAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106633093-B | n- (2-isopropyl acid) p-hydroxybenzoyl hydrazone lead complex as well as preparation method and application thereof | 商洛学院 | 2019-12-17 | — | — | CN | claimed |