Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | PDE4A | P27815 | 2/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | TNF | P01375 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.42 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL11556653 | 0.68 | PDE4A (0.77) | MAPTMAPK1PDE4APDE4BPDE4D | |
| SCHEMBL11157701 | 0.68 | LMNA (0.47) | MAPK1LMNAKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL11150663 | 0.67 | LMNA (0.46) | MAPK1LMNAKDM4EALDH1A1 | |
| SCHEMBL9852941 | 0.65 | SMN1; SMN2 (0.46) | CYP1A2LMNACYP2C19ALDH1A1HTT | |
| SCHEMBL7351948 | 0.63 | DRD2 (0.33) | MAPTKDM4EALDH1A1 | |
| SCHEMBL7344244 | 0.63 | AKR1B1 (0.38) | MAPTCYP3A4ALDH1A1 | |
| SCHEMBL7346523 | 0.63 | AKR1B1 (0.36) | MAPTKMT2AALDH1A1HTT | |
| SCHEMBL16181522 | 0.63 | CYP1A2 (0.60) | MAPTMAPK1CYP1A2CYP3A4KDM4E | |
| Hydrochloric Acid SCHEMBL7343407 | 0.62 | AKR1B1 (0.37) | MAPTCYP3A4ALDH1A1 | |
| SCHEMBL16831402 | 0.62 | MAPK1 (0.43) | MAPTMAPK1CYP3A4LMNAKDM4E |
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-1992013860-A1 | NEW 4,5,6,7-TETRAHYDRO-IMIDAZO-[4,5,lJK][1,4]-BENZODIAZEPINE-2-(1H)-THIONES, A METHOD OF PREPARING THEM AS WELL AS DRUGS CONTAINING THEM, AND INTERMEDIATES FOR THE PREPARATION OF THESE COMPOUNDS | BOEHRINGER MANNHEIM GMBH (DE) | 1992-08-20 | — | — | WO | disclosed |