Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | IL33 | O95760 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | RAF1 | P04049 | 1/20 | 0.32 |
| ▸ | GFER | P55789 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9700249 | 0.93 | NOS3 (0.33) | LMNAALDH1A1SMN1; SMN2MAPK1MEN1 | |
| SCHEMBL9700201 | 0.73 | DRD1 (0.33) | LMNASMN1; SMN2MAPK1PAX8TSHR | |
| SCHEMBL9701390 | 0.71 | PAX8 (0.34) | PAX8 | |
| SCHEMBL9702143 | 0.68 | MAOB (0.32) | — | |
| SCHEMBL9701430 | 0.64 | CA1 (0.33) | CA1CA2LMNAMAPTSMN1; SMN2 | |
| SCHEMBL9701219 | 0.62 | AKR1B1 (0.37) | ALDH1A1MAPK1 | |
| SCHEMBL27453650 | 0.61 | PNMT (0.41) | LMNAALDH1A1MAPTMAPK1TSHR | |
| SCHEMBL9700197 | 0.61 | MAOB (0.32) | LMNAALDH1A1MAPTSMN1; SMN2MAPK1 | |
| SCHEMBL11556533 | 0.58 | KCNJ1 (0.51) | ALDH1A1MAPTSMN1; SMN2HTTGFER | |
| SCHEMBL28662040 | 0.57 | MAPT (0.50) | CA1CA2LMNAALDH1A1MAPT |
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 |