Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 2/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.35 |
| ▸ | NPY1R | P25929 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9536944 | 0.81 | KCNH2 (0.49) | KCNH2NPY1RMAPT | |
| SCHEMBL9685945 | 0.80 | NPC1 (0.40) | TP53SLC6A9ALDH1A1LMNA | |
| SCHEMBL9537090 | 0.80 | TP53 (0.44) | TP53KCNH2ENPP2SLC6A9MEN1 | |
| SCHEMBL9629457 | 0.79 | CHRM4 (0.42) | KCNH2ENPP2SLC6A9MEN1KMT2A | |
| SCHEMBL9535843 | 0.79 | KCNH2 (0.54) | TP53KCNH2ENPP2MAPTLMNA | |
| Noberastine SCHEMBL18424 | 0.78 | NR4A2 (0.45) | TP53KCNH2MEN1KMT2AALDH1A1 | |
| SCHEMBL9539209 | 0.78 | LMNA (0.55) | TP53KCNH2ENPP2LMNA | |
| SCHEMBL9538101 | 0.77 | TP53 (0.47) | TP53KCNH2ENPP2SLC6A9NPY1R | |
| Oxalic Acid SCHEMBL9629525 | 0.76 | MEN1 (0.40) | TP53KCNH2ENPP2MEN1KMT2A | |
| Oxalic Acid SCHEMBL9629530 | 0.76 | MEN1 (0.40) | TP53KCNH2ENPP2MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0297661-B1 | [(Bicyclic heterocyclyl)methyl and -hetero] substituted hexahydro-1H-azepines and pyrrolidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1992-09-16 | — | — | EP | disclosed |
| US-5071846-A | Anti-hystaminic [(bicyclic heterocyclyl) methyl and --hetero] substituted hexahydro-1H-azepines and pyrrolidines | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-12-10 | — | — | US | disclosed |
| US-4988689-A | Antiallergens, antihistamines | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-01-29 | — | — | US | disclosed |