Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.61 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.61 |
| ▸ | CTNNB1 | P35222 | 7/20 | 0.54 |
| ▸ | WNT3A | P56704 | 7/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | PIR | O00625 | 1/20 | 0.48 |
| ▸ | HSF1 | Q00613 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | PRKCI | P41743 | 1/20 | 0.48 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.45 |
| ▸ | FOXO1 | Q12778 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL671055 | 0.82 | CTNNB1 (0.57) | TAS1R3TAS1R1CTNNB1WNT3ASMN1; SMN2 | |
| SCHEMBL27312616 | 0.82 | CTNNB1 (0.57) | TAS1R3TAS1R1CTNNB1WNT3APIR | |
| SCHEMBL28860886 | 0.82 | CTNNB1 (0.60) | TAS1R3TAS1R1CTNNB1WNT3APIR | |
| SCHEMBL3788073 | 0.81 | CTNNB1 (0.53) | TAS1R3TAS1R1CTNNB1WNT3ASMN1; SMN2 | |
| SCHEMBL1726294 | 0.80 | CTNNB1 (0.61) | TAS1R3TAS1R1CTNNB1WNT3APIR | |
| SCHEMBL3787714 | 0.80 | HPGD (0.54) | TAS1R3TAS1R1CTNNB1WNT3ASMN1; SMN2 | |
| SCHEMBL3807781 | 0.79 | NPC1 (0.63) | CTNNB1WNT3ASMN1; SMN2RAB9ANPC1 | |
| SCHEMBL24169997 | 0.79 | ALDH1A1 (0.58) | SMN1; SMN2RAB9ANPC1 | |
| SCHEMBL20932779 | 0.79 | ALDH1A1 (0.59) | SMN1; SMN2RAB9ANPC1 | |
| SCHEMBL31262479 | 0.79 | CTNNB1 (0.67) | TAS1R3TAS1R1CTNNB1WNT3ARAB9A |
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-2234486-A1 | BENZIMIDAZOLES AND ANALOGS AS RHO KINASE INHIBITORS | The Scripps Research Institute (US) | 2010-10-06 | — | — | EP | disclosed |
| WO-2009079011-A1 | BENZIMIDAZOLES AND ANALOGS AS RHO KINASE INHIBITORS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2009-06-25 | — | — | WO | disclosed |