Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | TPMT | P51580 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.39 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.39 |
| ▸ | TSPO | P30536 | 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 | |
|---|---|---|---|---|
| SCHEMBL21880196 | 0.93 | SMN1; SMN2 (0.44) | SMN1; SMN2THRBCES2CES1TPMT | |
| SCHEMBL28050614 | 0.81 | NPC1 (0.53) | SMN1; SMN2CES2CES1ALDH1A1NPC1 | |
| SCHEMBL20512976 | 0.80 | SMN1; SMN2 (0.42) | SMN1; SMN2THRBCES2CES1ALDH1A1 | |
| SCHEMBL58814 | 0.80 | ALDH1A1 (0.52) | CES2CES1ALDH1A1ATMTDP1 | |
| SCHEMBL37050 | 0.80 | LMNA (0.40) | SMN1; SMN2CES2CES1NPC1RAB9A | |
| SCHEMBL83199 | 0.79 | LMNA (0.56) | SMN1; SMN2CES2CES1ALDH1A1NPC1 | |
| SCHEMBL30308060 | 0.77 | SMN1; SMN2 (0.37) | SMN1; SMN2THRBCES2CES1TPMT | |
| Benzophenone SCHEMBL17435222 | 0.77 | HPGD (0.43) | SMN1; SMN2ALDH1A1ATMTDP1L3MBTL1 | |
| Trimethylammonium SCHEMBL28815416 | 0.77 | RAB9A (0.46) | SMN1; SMN2ALDH1A1L3MBTL1NPC1RAB9A | |
| SCHEMBL17446544 | 0.76 | CA2 (0.48) | CES2CES1ALDH1A1L3MBTL1NPC1 |
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-107427414-A | Polymerizable monomer for dental material, composition, adhesive dental material, and kit | 三井化学株式会社 | 2017-12-01 | — | — | CN | disclosed |
| CN-103260582-B | Curable composition for dental use | KURARAY NORITAKE DENTAL INC. (JP) | 2016-05-04 | — | — | CN | disclosed |