Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 6/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14865300 | 0.90 | TRPA1 (0.41) | P2RX7CNR2BACE1PTGES | |
| SCHEMBL2805697 | 0.89 | RAB9A (0.41) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL2780230 | 0.87 | CNR2 (0.40) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL2809946 | 0.86 | CNR2 (0.39) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| Trifluoroacetic Acid SCHEMBL2809036 | 0.86 | RAB9A (0.38) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL2807298 | 0.85 | CNR2 (0.40) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL19418576 | 0.85 | CNR2 (0.39) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL13159819 | 0.84 | CNR2 (0.38) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL2811071 | 0.84 | RAB9A (0.44) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E | |
| SCHEMBL2809043 | 0.84 | CNR2 (0.38) | RAB9ACYP1A2CYP2D6CYP2C19KDM4E |
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-2401256-B1 | Compounds as bradykinin B1 antagonists | BOEHRINGER INGELHEIM INT (DE) | 2013-04-17 | — | — | EP | disclosed |