Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.63 |
| ▸ | NPY1R | P25929 | 1/20 | 0.63 |
| ▸ | NPY2R | P49146 | 1/20 | 0.63 |
| ▸ | MAPT | P10636 | 3/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.62 |
| ▸ | RAB9A | P51151 | 3/20 | 0.62 |
| ▸ | NPC1 | O15118 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 4/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.58 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL28701426 | 0.81 | MAPT (0.67) | ALDH1A1NPY1RNPY2RMAPTSMN1; SMN2 | |
| SCHEMBL13312447 | 0.81 | SOAT1 (0.58) | ALDH1A1NPY1RNPY2RMAPTSMN1; SMN2 | |
| SCHEMBL14075090 | 0.80 | ALDH1A1 (0.59) | ALDH1A1NPY1RNPY2RMAPTSMN1; SMN2 | |
| SCHEMBL10634666 | 0.79 | KDM4E (0.68) | ALDH1A1MAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL789303 | 0.78 | MAPT (0.62) | ALDH1A1NPY1RNPY2RMAPTSMN1; SMN2 | |
| SCHEMBL3172180 | 0.78 | HTT (0.62) | ALDH1A1NPY1RNPY2RMAPTSMN1; SMN2 | |
| SCHEMBL6206191 | 0.78 | ALDH1A1 (0.69) | ALDH1A1NPY1RNPY2RMAPTSMN1; SMN2 | |
| SCHEMBL18762046 | 0.78 | CHRM3 (0.55) | ALDH1A1MAPTKDM4ECYP2C9LMNA | |
| Hydrochloric Acid SCHEMBL8410814 | 0.78 | ALDH1A1 (0.59) | ALDH1A1NPY1RNPY2RMAPTSMN1; SMN2 | |
| SCHEMBL4082544 | 0.77 | ALDH1A1 (0.61) | ALDH1A1MAPTKDM4ECYP2C9L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1830858-A2 | 3, 6-BICYCLOLIDES | Enanta Pharmaceuticals, Inc. (US) | 2007-09-12 | — | — | EP | disclosed |
| WO-2006063039-A2 | 3, 6-BICYCLOLIDES | ENANTA PHARMACEUTICALS, INC. (US) | 2006-06-15 | — | — | WO | disclosed |