Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.48 |
| ▸ | CASP1 | P29466 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 5/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29451814 | 0.79 | CASP1 (0.44) | ALDH1A1CASP1TSHRCYP3A4PDE10A | |
| SCHEMBL10297510 | 0.78 | LMNA (0.40) | ALDH1A1MAPTKDM4ELMNASMN1; SMN2 | |
| SCHEMBL19375587 | 0.78 | BRD4 (0.34) | ALDH1A1CASP1GAA | |
| SCHEMBL8491702 | 0.76 | ALDH1A1 (0.54) | ALDH1A1CASP1TSHRCYP3A4PDE10A | |
| SCHEMBL30678438 | 0.76 | ALDH1A1 (0.54) | ALDH1A1CASP1TSHRCYP3A4PDE10A | |
| SCHEMBL24717405 | 0.76 | ALDH1A1 (0.54) | ALDH1A1CASP1TSHRCYP3A4PDE10A | |
| SCHEMBL23050060 | 0.75 | LMNA (0.52) | ALDH1A1LMNASMN1; SMN2L3MBTL1ACHE | |
| SCHEMBL30663814 | 0.74 | TSHR (0.33) | ALDH1A1TSHRCYP3A4MAPTKDM4E | |
| SCHEMBL20708758 | 0.74 | ALDH1A1 (0.52) | ALDH1A1CASP1TSHRCYP3A4PDE10A | |
| SCHEMBL8528741 | 0.73 | PDE7A (0.53) | ALDH1A1CASP1TSHRCYP3A4MAPT |
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-2012033069-A1 | PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS | 大鵬薬品工業株式会社 (JP) | 2012-03-15 | — | — | WO | disclosed |