Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 5/20 | 0.36 |
| ▸ | HRH1 | P35367 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA3 | P07451 | 2/20 | 0.32 |
| ▸ | CA4 | P22748 | 2/20 | 0.32 |
| ▸ | CA6 | P23280 | 2/20 | 0.32 |
| ▸ | CA5A | P35218 | 2/20 | 0.32 |
| ▸ | CA7 | P43166 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.32 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.32 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19737031 | 0.75 | — | — | |
| SCHEMBL19736669 | 0.75 | NOS2 (0.38) | TLR8HRH1MAOADNM1LMNA | |
| SCHEMBL19737032 | 0.68 | — | — | |
| SCHEMBL17277543 | 0.64 | MAOA (0.41) | TLR8HRH1MAOA | |
| Methylamine SCHEMBL27305994 | 0.63 | DNM1 (0.80) | CA12CA1CA2CA3CA4 | |
| Methylamine SCHEMBL27747561 | 0.63 | DNM1 (0.80) | CA12CA1CA2CA3CA4 | |
| Diaminooctane SCHEMBL9863969 | 0.63 | CYP3A4 (0.59) | HRH1MAOACA12CA1CA2 | |
| P-Xylene SCHEMBL28929073 | 0.60 | CYP1A2 (0.55) | CA12CA1CA2CA3CA4 | |
| SCHEMBL31181811 | 0.60 | CA12 (0.42) | HRH1MAOACA12CA1CA2 | |
| SCHEMBL31181810 | 0.60 | CA12 (0.42) | HRH1MAOACA12CA1CA2 |
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-2017218886-A1 | COMPOSITIONS AND METHODS FOR REACTIVATING CHOLINESTERASES | THE HENRY M. JACKSON FOUNDATION FOR THE ADVANCEMENT OF MILITARY MEDICINE, INC. (US) | 2017-12-21 | — | — | WO | disclosed |