Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 8/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.38 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL16631329 | 0.82 | ROCK2 (0.44) | ROCK2AKR1B1MAOA | |
| SCHEMBL18165307 | 0.77 | AKR1B1 (0.47) | ROCK2AKR1B1AAK1KCNJ1KCNH2 | |
| SCHEMBL803505 | 0.75 | KCNJ1 (0.43) | ROCK2AKR1B1AAK1KCNJ1KCNH2 | |
| SCHEMBL16631067 | 0.74 | ITGB3 (0.46) | MAOA | |
| SCHEMBL10898501 | 0.73 | HTR2C (0.54) | KDM4ENPC1LMNATP53CYP1A2 | |
| SCHEMBL4469820 | 0.72 | ROCK2 (0.51) | ROCK2 | |
| SCHEMBL9980133 | 0.72 | PARP1 (0.44) | ROCK2AKR1B1AAK1KCNJ1KCNH2 | |
| SCHEMBL10899522 | 0.72 | RAB9A (0.47) | KDM4ENPC1LMNATP53CYP1A2 | |
| SCHEMBL18165301 | 0.71 | AKR1B1 (0.47) | ROCK2AKR1B1MAOA | |
| SCHEMBL10897771 | 0.70 | HSD17B1 (0.58) | AKR1B1KDM4ENPC1LMNATP53 |
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-2015051045-A2 | 3'END CAPS FOR RNAi AGENTS FOR USE IN RNA INTERFERENCE | NOVARTIS AG (CH) | 2015-04-09 | — | — | WO | disclosed |