Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CDK8 | P49336 | 2/20 | 0.33 |
| ▸ | ENO1 | P06733 | 1/20 | 0.33 |
| ▸ | VNN1 | O95497 | 1/20 | 0.32 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CTSL | P07711 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CTSH | P09668 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28946375 | 0.79 | HCRTR1 (0.46) | KMT2A | |
| SCHEMBL18166955 | 0.78 | CHRM2 (0.33) | ALDH1A1ENO1MEN1MAPTKMT2A | |
| SCHEMBL28787824 | 0.76 | LMNA (0.33) | ALDH1A1ENO1MEN1MAPTKMT2A | |
| SCHEMBL28876754 | 0.76 | NR1H2 (0.30) | — | |
| Hydrochloric Acid SCHEMBL28782905 | 0.75 | ENO1 (0.32) | ALDH1A1ENO1MEN1MAPTKMT2A | |
| SCHEMBL8330673 | 0.74 | CHRNB4 (0.34) | ALDH1A1FKBP1ABCHECHRNB2CHRNB4 | |
| SCHEMBL28820105 | 0.74 | PIM1 (0.32) | ENO1 | |
| SCHEMBL28824422 | 0.74 | ALDH1A1 (0.41) | ALDH1A1BCHEMEN1MAPTKMT2A | |
| SCHEMBL22290470 | 0.73 | MEN1 (0.54) | ALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL695894 | 0.73 | MEN1 (0.54) | ALDH1A1MEN1MAPTKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101087794-B | Pharmaceutical compounds | HOFFMANN LA ROCHE | 2011-05-18 | — | — | CN | disclosed |
| CN-101087794-A | Pharmaceutical compounds | PIRAMED LTD (GB) | 2007-12-12 | — | — | CN | disclosed |
| CN-1968954-A | Thienopyridine Derivatives | SANKYO CO (JP) | 2007-05-23 | — | — | CN | disclosed |