Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.42 |
| ▸ | APOB | P04114 | 1/20 | 0.41 |
| ▸ | MTTP | P55157 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3726876 | 0.91 | SMN1; SMN2 (0.48) | SMN1; SMN2GAANPC1RAB9AMEN1 | |
| SCHEMBL27603332 | 0.83 | MAPT (0.42) | SMN1; SMN2ALDH1A1MAPTTP53THRB | |
| SCHEMBL3737489 | 0.82 | MTTP (0.56) | NPC1RAB9AALDH1A1MTTP | |
| SCHEMBL3727582 | 0.82 | MTTP (0.48) | SMN1; SMN2GAAALDH1A1MAPTTP53 | |
| SCHEMBL3723677 | 0.80 | APOB (0.47) | SMN1; SMN2GAANPC1RAB9AMEN1 | |
| SCHEMBL3727747 | 0.79 | PDK2 (0.39) | SMN1; SMN2GAANPC1RAB9AMAPT | |
| SCHEMBL3730445 | 0.79 | KDM4E (0.46) | SMN1; SMN2GAAAPOBMTTP | |
| SCHEMBL27622125 | 0.78 | S1PR1 (0.42) | MAPTTP53TRPV4APOBMTTP | |
| SCHEMBL3730634 | 0.78 | MTTP (0.43) | ALDH1A1APOBMTTP | |
| SCHEMBL27622118 | 0.78 | ALDH1A1 (0.40) | ALDH1A1MAPTTP53TRPV4APOB |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101838218-A | Ester compound and pharmaceutical use of the same | JAPAN TOBACCO INC | 2010-09-22 | — | — | CN | claimed |
| CN-1630629-A | Ester compound and medical use thereof | JAPAN TOBACCO INC (JP) | 2005-06-22 | — | — | CN | claimed |
| CN-101838218-A | Ester compound and pharmaceutical use of the same | JAPAN TOBACCO INC | 2010-09-22 | — | — | CN | disclosed |
| CN-1630629-B | Ester compound and medical use thereof | JAPAN TOBACCO INC | 2010-05-05 | — | — | CN | disclosed |
| CN-1943786-A | Ester compound and its medicinal application | JAPAN TOBACCO INC (JP) | 2007-04-11 | — | — | CN | disclosed |
| CN-1630629-A | Ester compound and medical use thereof | JAPAN TOBACCO INC (JP) | 2005-06-22 | — | — | CN | disclosed |