Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PHGDH | O43175 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5128339 | 1.00 | MAPT (0.47) | MAPTCYP1A2CYP2D6FAAHHTR2A | |
| SCHEMBL8220342 | 0.79 | MAPT (0.49) | MAPTCYP1A2CYP2D6FAAHRAB9A | |
| SCHEMBL2162730 | 0.79 | CTSS (0.48) | MAPTCYP1A2CYP2D6ALDH1A1RAB9A | |
| SCHEMBL12196254 | 0.79 | CTSS (0.48) | MAPTCYP1A2CYP2D6ALDH1A1RAB9A | |
| SCHEMBL2162724 | 0.79 | CTSS (0.48) | MAPTCYP1A2CYP2D6ALDH1A1RAB9A | |
| SCHEMBL12255060 | 0.77 | HTR2A (0.56) | MAPTCYP1A2CYP2D6HTR2AALDH1A1 | |
| SCHEMBL14139290 | 0.75 | CTSS (0.49) | MAPTCYP1A2CYP2D6FAAHALDH1A1 | |
| SCHEMBL14139306 | 0.74 | MAPT (0.52) | MAPTRAB9APOLBAKR1C3KDM4E | |
| SCHEMBL21097115 | 0.73 | HTR2A (0.59) | MAPTCYP1A2CYP2D6HTR2AALDH1A1 | |
| SCHEMBL6286462 | 0.72 | CYP2C19 (0.53) | MAPTCYP1A2ALDH1A1RAB9APOLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1744755-A4 | COMPOUNDS AND COMPOSITIONS AS CATHEPSIN S INHIBITORS | IRM LLC (BM) | 2009-07-15 | — | — | EP | disclosed |
| EP-1744755-A2 | COMPOUNDS AND COMPOSITIONS AS CATHEPSIN S INHIBITORS | IRM, LLC (BM) | 2007-01-24 | — | — | EP | disclosed |
| WO-2005107464-A2 | COMPOUNDS AND COMPOSITIONS AS CATHEPSIN S INHIBITORS | IRM LLC (BM) | 2005-11-17 | — | — | WO | disclosed |