Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL11896114 | 0.79 | TRPA1 (0.53) | TRPA1HPGDEPHX1GRIN2BOPRM1 | |
| SCHEMBL11966212 | 0.79 | TRPA1 (0.53) | TRPA1HPGDEPHX1GRIN2BOPRM1 | |
| SCHEMBL11970214 | 0.79 | TRPA1 (0.53) | TRPA1HPGDEPHX1GRIN2BOPRM1 | |
| SCHEMBL11895309 | 0.79 | TRPA1 (0.53) | TRPA1HPGDEPHX1GRIN2BOPRM1 | |
| SCHEMBL11895477 | 0.79 | TRPA1 (0.53) | TRPA1HPGDEPHX1GRIN2BOPRM1 | |
| SCHEMBL19857407 | 0.77 | OPRM1 (0.44) | TRPA1HPGDEPHX1GRIN2BOPRM1 | |
| SCHEMBL19857422 | 0.77 | OPRM1 (0.44) | TRPA1HPGDEPHX1GRIN2BOPRM1 | |
| SCHEMBL17822692 | 0.76 | GRIN2B (0.41) | TRPA1HPGDEPHX1GRIN2BOPRM1 | |
| SCHEMBL2126895 | 0.75 | HPGD (0.46) | HPGDEPHX1OPRM1OPRL1RAB9A | |
| SCHEMBL23266034 | 0.75 | OPRM1 (0.43) | TRPA1HPGDEPHX1GRIN2BOPRM1 |
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-2245016-A1 | SUBSTITUTED AMINO-BENZIMIDAZOLES, MEDICAMENTS COMPRISING SAID COMPOUND, THEIR USE AND THEIR METHOD OF MANUFACTURE | Boehringer Ingelheim International GmbH (DE) | 2010-11-03 | — | — | EP | disclosed |
| WO-2009092566-A1 | SUBSTITUTED AMINO-BENZIMIDAZOLES, MEDICAMENTS COMPRISING SAID COMPOUND, THEIR USE AND THEIR METHOD OF MANUFACTURE | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-07-30 | — | — | WO | disclosed |