Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | PNMT | P11086 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4748908 | 0.84 | DRD1 (0.33) | — | |
| SCHEMBL3308477 | 0.84 | DRD1 (0.33) | — | |
| SCHEMBL4749337 | 0.78 | ALDH1A1 (0.36) | NPC1RAB9A | |
| SCHEMBL2838035 | 0.77 | NPC1 (0.36) | NPC1RAB9APNMT | |
| Hydrochloric Acid SCHEMBL2835985 | 0.75 | SLC6A4 (0.36) | — | |
| SCHEMBL4751909 | 0.73 | NPC1 (0.49) | NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL2836791 | 0.73 | MEN1 (0.36) | — | |
| SCHEMBL11218070 | 0.71 | NPC1 (0.47) | NPC1RAB9A | |
| SCHEMBL11214213 | 0.71 | SLC6A2 (0.55) | — | |
| SCHEMBL10999940 | 0.70 | SLC6A4 (0.57) | NPC1RAB9A |
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-2008135526-A1 | CARBOXYLIC ACID AMIDES AS FACTOR XA INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-11-13 | — | — | WO | disclosed |