Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB1 | P15086 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | CTSL | P07711 | 1/20 | 0.47 |
| ▸ | CTSB | P07858 | 1/20 | 0.47 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL31470357 | 0.87 | CPB1 (0.57) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL19630135 | 0.86 | CPB1 (0.58) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL20749075 | 0.86 | CPB1 (0.58) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL28914414 | 0.86 | CPB1 (0.58) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL28914412 | 0.86 | CPB1 (0.58) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL24920352 | 0.86 | ALDH1A1 (0.53) | CPB1ALDH1A1GAATSHRCYP2C9 | |
| SCHEMBL2190928 | 0.85 | CPB1 (0.55) | CPB1ALDH1A1GAATSHRCYP2C9 | |
| SCHEMBL7501170 | 0.85 | CPB1 (0.54) | CPB1ALDH1A1GAATSHRCYP3A4 | |
| SCHEMBL29512123 | 0.84 | KMT2A (0.53) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL4574080 | 0.83 | CPB1 (0.60) | CPB1ALDH1A1GAATSHREPHX1 |
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-2008095912-A2 | ENANTIOPURE PHARMACOLOGICALLY ACTIVE TRICYCLIC BENZIMIDAZOLES | NYCOMED GMBH (DE) | 2008-08-14 | — | — | WO | disclosed |