Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.73 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.64 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.64 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.63 |
| ▸ | BCHE | P06276 | 1/20 | 0.61 |
| ▸ | TNKS | O95271 | 1/20 | 0.60 |
| ▸ | PARP1 | P09874 | 1/20 | 0.60 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.60 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.60 |
| ▸ | SOAT1 | P35610 | 5/20 | 0.58 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.56 |
| ▸ | AR | P10275 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9514091 | 0.88 | RAB9A (0.74) | RAB9AGRIN2AGRIN2BEPHX2BCHE | |
| SCHEMBL9512664 | 0.88 | RAB9A (0.78) | RAB9AGRIN2AGRIN2BEPHX2BCHE | |
| SCHEMBL9513272 | 0.86 | RAB9A (0.76) | RAB9AGRIN2AGRIN2BEPHX2BCHE | |
| SCHEMBL1704979 | 0.85 | RAB9A (0.74) | RAB9AGRIN2AGRIN2BEPHX2BCHE | |
| SCHEMBL3844538 | 0.85 | RAB9A (0.70) | RAB9AGRIN2AGRIN2BEPHX2BCHE | |
| SCHEMBL9514685 | 0.84 | RAB9A (1.00) | RAB9AGRIN2AGRIN2BEPHX2BCHE | |
| Hydrochloric Acid SCHEMBL1704951 | 0.84 | RAB9A (0.73) | RAB9AGRIN2AGRIN2BEPHX2BCHE | |
| Hydrochloric Acid SCHEMBL699487 | 0.83 | RAB9A (0.97) | RAB9AGRIN2AGRIN2BEPHX2BCHE | |
| SCHEMBL4508692 | 0.82 | RAB9A (0.65) | RAB9AGRIN2AGRIN2BEPHX2BCHE | |
| SCHEMBL3841576 | 0.79 | RAB9A (0.58) | RAB9AGRIN2AGRIN2BTNKSPARP1 |
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-1460065-B1 | PROCESSES FOR PRODUCTION OF CYCLIC DIAMINE COMPOUNDS OR SALTS THEREOF | KOWA CO (JP) | 2012-12-05 | — | — | EP | disclosed |
| EP-1566381-B1 | PROCESS FOR PRODUCTION OF 1- 2-(BENZIMIDAZOL-2-YL- THIO)ETHYL PIPERAZINE OR SALTS THEREOF | KOWA CO (JP) | 2009-11-11 | — | — | EP | disclosed |