Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATG4B | Q9Y4P1 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 8/20 | 0.35 |
| ▸ | TCF7L2 | Q9NQB0 | 8/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27675408 | 0.91 | MEN1 (0.39) | ATG4BALDH1A1POLBCASP3SENP8 | |
| SCHEMBL27675437 | 0.86 | PDE4A (0.45) | ALDH1A1POLBL3MBTL1GAAPDE4A | |
| SCHEMBL27675500 | 0.85 | ACHE (0.45) | ALDH1A1L3MBTL1KMT2A | |
| SCHEMBL27655434 | 0.85 | KDM4E (0.42) | ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27655551 | 0.85 | KDM4E (0.38) | ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27655446 | 0.83 | KDM4E (0.39) | ALDH1A1KDM4ECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27675428 | 0.83 | KDM4E (0.43) | ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL5118955 | 0.78 | HTT (0.43) | ATG4BALDH1A1POLBCASP3SENP8 | |
| SCHEMBL8185246 | 0.77 | MEN1 (0.45) | ATG4BALDH1A1POLBCASP3SENP8 | |
| SCHEMBL27655527 | 0.76 | KDM4E (0.52) | ALDH1A1HTTKDM4ECYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1875023-A | Use of thienopyrimidines | MERCK PATENT GMBH (DE) | 2006-12-06 | — | — | CN | disclosed |