Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | RHEB | Q15382 | 2/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.54 |
| ▸ | PDE4A | P27815 | 1/20 | 0.53 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.53 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.53 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9385441 | 0.84 | NPC1 (0.53) | ALDH1A1HPGDKDM4EHSD17B10RHEB | |
| SCHEMBL9378150 | 0.81 | ALDH1A1 (0.62) | ALDH1A1HPGDKDM4EHSD17B10RHEB | |
| SCHEMBL10699867 | 0.80 | NPC1 (0.58) | ALDH1A1HPGDKDM4EHSD17B10NPC1 | |
| SCHEMBL9385123 | 0.79 | ALDH1A1 (0.52) | ALDH1A1HPGDKDM4EHSD17B10RHEB | |
| SCHEMBL9678498 | 0.78 | ALDH1A1 (0.62) | ALDH1A1HPGDKDM4EHSD17B10RHEB | |
| Hydrochloric Acid SCHEMBL9703454 | 0.78 | ALDH1A1 (0.51) | ALDH1A1HPGDKDM4EHSD17B10RHEB | |
| SCHEMBL9599136 | 0.75 | ALDH1A1 (0.57) | ALDH1A1HPGDKDM4EHSD17B10RHEB | |
| SCHEMBL9379605 | 0.75 | ALDH1A1 (0.57) | ALDH1A1HPGDKDM4EHSD17B10RHEB | |
| SCHEMBL24075259 | 0.74 | GUSB (0.76) | ALDH1A1HPGDKDM4EHSD17B10RHEB | |
| SCHEMBL11225571 | 0.74 | RHEB (1.00) | ALDH1A1HPGDKDM4EHSD17B10RHEB |
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 |
|---|---|---|---|---|---|---|---|
| US-5116843-A | Anticoagulants, hypotensive agents and cardiovascular disorder | BOEHRINGER MANNHEIM GMBH (DE) | 1992-05-26 | — | — | US | disclosed |
| EP-0275888-A2 | Tricyclic benzimidazoles, process for their preparation and use as medicaments | Roche Diagnostics GmbH (DE) | 1988-07-27 | — | — | EP | disclosed |