Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | NCEH1 | Q6PIU2 | 7/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL799296 | 0.86 | NCEH1 (0.55) | NCEH1TSHRRAB9APKMNPC1 | |
| SCHEMBL10868413 | 0.84 | HSD17B10 (0.54) | ACHETSHRRAB9ANPC1HTR2A | |
| SCHEMBL7145115 | 0.80 | KMT2A (0.49) | ACHENCEH1HTR2ASLC6A4KCNH2 | |
| SCHEMBL16965115 | 0.80 | RAB9A (0.60) | NCEH1TSHRRAB9APKMNPC1 | |
| SCHEMBL11799252 | 0.79 | RAB9A (0.47) | NCEH1TSHRRAB9APKMNPC1 | |
| SCHEMBL9493150 | 0.76 | HTR2A (0.54) | ACHETSHRHTR2ASLC6A4KCNH2 | |
| SCHEMBL8058253 | 0.76 | ACHE (0.53) | ACHENCEH1TSHRRAB9APKM | |
| SCHEMBL10574854 | 0.76 | ALDH1A1 (0.65) | ACHENCEH1TSHRRAB9APKM | |
| SCHEMBL29728586 | 0.74 | NCEH1 (0.54) | NCEH1TSHRRAB9APKMNPC1 | |
| SCHEMBL16965297 | 0.74 | NCEH1 (0.54) | NCEH1TSHRRAB9APKMNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4677222-A | NERVE GAS FOR CHEMICAL WARFARE | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1987-06-30 | — | — | US | disclosed |