Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | CTSD | P07339 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL12389756 | 0.87 | MAPT (0.45) | RAB9AMAPTSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL12390182 | 0.86 | SRD5A2 (0.46) | RAB9AMAPTSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL2260956 | 0.82 | HTR2B (0.49) | RAB9AMAPTSMN1; SMN2DRD2HTR2A | |
| SCHEMBL13384523 | 0.82 | MAPT (0.37) | RAB9AMAPTSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL12390265 | 0.81 | MAPT (0.43) | RAB9AMAPTSMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL2257199 | 0.81 | RAB9A (0.43) | RAB9AMAPTSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL2257195 | 0.81 | RAB9A (0.43) | RAB9AMAPTSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL12388971 | 0.81 | MAPT (0.43) | RAB9AMAPTSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL13384591 | 0.80 | CA1 (0.46) | RAB9AMAPTSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL13384521 | 0.79 | CA1 (0.45) | RAB9AMAPTSMN1; SMN2ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2177505-A1 | BICYCLIC ACYLGUANIDINE DERIVATIVE | Astellas Pharma Inc. (JP) | 2010-04-21 | — | — | EP | disclosed |