Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 8/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.40 |
| ▸ | GUSB | P08236 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7387113 | 0.91 | AMY1A (0.42) | AMY1ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL7392370 | 0.87 | AMY1A (0.46) | AMY1ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL7389024 | 0.87 | AMY1A (0.54) | AMY1ANPC1RAB9AATMERAP1 | |
| SCHEMBL7392857 | 0.83 | RAB9A (0.49) | AMY1ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL7393384 | 0.77 | NPBWR1 (0.51) | AMY1ANPC1RAB9AALDH1A1MAPT | |
| SCHEMBL7399325 | 0.77 | RAB9A (0.47) | AMY1ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL7396331 | 0.76 | KDM4E (0.53) | AMY1ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL295717 | 0.75 | GUSB (0.48) | NPC1RAB9AGUSBKDM4E | |
| SCHEMBL7992209 | 0.74 | AMY1A (0.43) | AMY1ANPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL7396880 | 0.73 | NPBWR1 (0.51) | AMY1ANPC1RAB9AMAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001066526-A1 | ESTER DERIVATIVES OF DIMETHYLPROPIONIC ACID AND PHARMACETUICAL COMPOSITIONS CONTAINING THEM | CERMOL S.A. (CH) | 2001-09-13 | — | — | WO | disclosed |