Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 5/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.51 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.51 |
| ▸ | AHR | P35869 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL18415466 | 0.85 | ALDH1A1 (0.53) | ALDH1A1KDM4EL3MBTL1KMT2ANPSR1 | |
| SCHEMBL16438566 | 0.85 | ALDH1A1 (0.53) | ALDH1A1KDM4EL3MBTL1KMT2ANPSR1 | |
| SCHEMBL17206120 | 0.84 | HSD17B1 (0.55) | ALDH1A1KDM4EL3MBTL1KMT2ANPSR1 | |
| SCHEMBL28476585 | 0.80 | ALDH1A1 (0.58) | ALDH1A1KDM4EL3MBTL1KMT2ANPSR1 | |
| SCHEMBL27968873 | 0.79 | MTNR1A (0.47) | ALDH1A1KDM4EL3MBTL1KMT2ANPSR1 | |
| SCHEMBL28156747 | 0.79 | ALDH1A1 (0.49) | ALDH1A1KDM4EL3MBTL1KMT2AHTT | |
| SCHEMBL6206191 | 0.79 | ALDH1A1 (0.69) | ALDH1A1KDM4EL3MBTL1KMT2AHTT | |
| SCHEMBL5160407 | 0.78 | ALDH1A1 (0.61) | ALDH1A1KDM4EKMT2AHTTSMN1; SMN2 | |
| SCHEMBL18415536 | 0.78 | MAPT (0.62) | ALDH1A1KDM4EL3MBTL1KMT2ANPSR1 | |
| SCHEMBL3683226 | 0.78 | ALDH1A1 (0.58) | ALDH1A1KDM4EKMT2ANPSR1HTT |
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-107790186-B | Novel decamethyl cyclopentadienyl zirconium complex and preparation method and application thereof | 山西医科大学 | 2020-10-30 | — | — | CN | disclosed |
| CN-107790186-A | A kind of new decamethyl Zirconocenes and its preparation method and application | 山西医科大学 | 2018-03-13 | — | — | CN | disclosed |