Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | PKN1 | Q16512 | 5/20 | 0.51 |
| ▸ | PKN2 | Q16513 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.51 |
| ▸ | HPGD | P15428 | 4/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | RHEB | Q15382 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | CBFB | Q13951 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30108052 | 0.81 | ALDH1A1 (0.58) | ALDH1A1PKN1PKN2KDM4EHPGD | |
| SCHEMBL6220036 | 0.80 | PKN1 (0.50) | ALDH1A1PKN1PKN2KDM4EHPGD | |
| SCHEMBL4248197 | 0.78 | PKN1 (0.55) | ALDH1A1PKN1PKN2KDM4EHPGD | |
| SCHEMBL125825 | 0.77 | CBFB (0.81) | KDM4EHPGDCBFBNPC1RAB9A | |
| Ridinilazole SCHEMBL413723 | 0.77 | ALDH1A1 (0.66) | ALDH1A1PKN1PKN2KDM4EHPGD | |
| Ridinilazole SCHEMBL29379856 | 0.77 | ALDH1A1 (0.66) | ALDH1A1PKN1PKN2KDM4EHPGD | |
| SCHEMBL125123 | 0.76 | CBFB (0.63) | KDM4EHPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL21816537 | 0.75 | CBFB (0.43) | ALDH1A1KDM4EHPGDCBFBNPC1 | |
| SCHEMBL22772169 | 0.75 | CBFB (0.43) | ALDH1A1CYP1A2CYP2C19CBFBMAPT | |
| SCHEMBL10219450 | 0.75 | CBFB (0.43) | ALDH1A1KDM4EHPGDHSD17B10CYP1A2 |
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-1194425-A1 | SUBSTITUTED BENZIMIDAZOLE | Aventis Pharma Deutschland GmbH (DE) | 2002-04-10 | — | — | EP | disclosed |
| WO-2001000610-A1 | SUBSTITUTED BENZIMIDAZOLE | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2001-01-04 | — | — | WO | disclosed |