Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28161538 | 0.82 | KDM4E (0.46) | KDM4EALDH1A1MAPTSMN1; SMN2NPC1 | |
| SCHEMBL28160834 | 0.80 | KDM4E (0.50) | KDM4EALDH1A1MAPTSMN1; SMN2NPC1 | |
| SCHEMBL30997233 | 0.76 | KDM4E (0.80) | KDM4EALDH1A1MAPTSMN1; SMN2NPC1 | |
| SCHEMBL2807005 | 0.75 | ALDH1A1 (0.56) | KDM4EALDH1A1MAPTSMN1; SMN2NPC1 | |
| SCHEMBL9518758 | 0.75 | KDM4E (0.56) | KDM4EALDH1A1MAPTSMN1; SMN2NPC1 | |
| SCHEMBL9518821 | 0.75 | ALDH1A1 (0.65) | KDM4EALDH1A1MAPTSMN1; SMN2NPC1 | |
| SCHEMBL3597471 | 0.73 | KDM4E (0.55) | KDM4EALDH1A1MAPTSMN1; SMN2NPC1 | |
| SCHEMBL28160833 | 0.72 | ALDH1A1 (0.50) | KDM4EALDH1A1MAPTSMN1; SMN2NPC1 | |
| SCHEMBL3869652 | 0.70 | KDM4E (1.00) | KDM4EALDH1A1MAPTSMN1; SMN2NPC1 | |
| SCHEMBL11606402 | 0.69 | CYP2C9 (0.43) | KDM4EALDH1A1MAPTSMN1; SMN2NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107001356-B | Indoli zine derivatives for neurodegenerative disorders | 默克专利有限公司 | 2019-09-03 | — | — | CN | disclosed |
| CN-107001356-A | Indoli zine derivatives for neurodegenerative disorders | 默克专利有限公司 | 2017-08-01 | — | — | CN | disclosed |