Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.66 |
| ▸ | MAOB | P27338 | 1/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | EGFR | P00533 | 5/20 | 0.61 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 3/20 | 0.58 |
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | NHERF1 | O14745 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | JAK2 | O60674 | 1/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.53 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.53 |
| ▸ | PYGL | P06737 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL10466165 | 0.88 | MAOA (0.71) | MAOAMAOBKDM4EALDH1A1EGFR | |
| SCHEMBL22718557 | 0.85 | PLD2 (0.56) | MAOAMAOBKDM4EALDH1A1GAA | |
| SCHEMBL28028277 | 0.85 | MAOA (0.63) | MAOAMAOBEGFRPIK3CATP53 | |
| SCHEMBL27325791 | 0.83 | MAOA (0.60) | MAOAMAOBALDH1A1EGFRPIK3CA | |
| SCHEMBL28028735 | 0.82 | MMP13 (0.66) | KDM4EALDH1A1GAAMAPK1EGFR | |
| SCHEMBL24601450 | 0.82 | MMP13 (0.72) | MAOAMAOBKDM4EALDH1A1GAA | |
| SCHEMBL8205048 | 0.81 | NHERF1 (0.64) | MAOAMAOBKDM4EALDH1A1EGFR | |
| SCHEMBL7533561 | 0.81 | NPC1 (0.74) | MAOAMAOBKDM4EEGFRPIK3CA | |
| SCHEMBL27690981 | 0.81 | MAOA (0.72) | MAOAMAOBALDH1A1EGFRPIK3CA | |
| SCHEMBL28028263 | 0.81 | MAOA (0.58) | MAOAMAOBKDM4EEGFRPIK3CA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104860866-A | 5-(substituted carbonylamino)-1H-indole-2-carbohydrazide derivatives as well as preparation method and application thereof | UNIV XIAMEN | 2015-08-26 | — | — | CN | claimed |
| CN-104860866-B | 5- (substitution carbon acylamino) -1H- indoles -2- carbohydrazide derivatives and its preparation method and application | 厦门大学 | 2018-07-17 | — | — | CN | disclosed |
| CN-104860866-A | 5-(substituted carbonylamino)-1H-indole-2-carbohydrazide derivatives as well as preparation method and application thereof | UNIV XIAMEN | 2015-08-26 | — | — | CN | disclosed |