Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9330568 | 0.95 | AKR1C1 (0.47) | AKR1C1LMNAHTTCYP2D6ALOX15 | |
| SCHEMBL8105095 | 0.87 | AKR1C1 (0.46) | AKR1C1LMNAHTTCYP2D6ALOX15 | |
| SCHEMBL12020309 | 0.87 | AKR1C1 (0.46) | AKR1C1LMNAHTTCYP2D6ALOX15 | |
| SCHEMBL8107068 | 0.87 | AKR1C1 (0.46) | AKR1C1LMNAHTTCYP2D6ALOX15 | |
| SCHEMBL3918465 | 0.83 | SLC6A3 (0.50) | AKR1C1LMNAHTTHDAC4SLC6A3 | |
| SCHEMBL2877324 | 0.81 | RXFP1 (0.38) | AKR1C1LMNAHTTHDAC4SLC6A3 | |
| SCHEMBL28838197 | 0.81 | AKR1C1 (0.45) | AKR1C1CYP2D6SLC6A3MAPK1SLC6A2 | |
| SCHEMBL4939280 | 0.80 | CCR2 (0.42) | HDAC4SLC6A3MAPK1SLC6A4 | |
| SCHEMBL10526589 | 0.80 | AKR1C1 (0.47) | AKR1C1LMNAHTTHDAC4SLC6A3 | |
| SCHEMBL4944760 | 0.80 | CYP2D6 (0.47) | LMNACYP2D6 |
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-5331010-A | TREATING MAMMALS FOR CONVULSIONS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 1994-07-19 | — | — | US | disclosed |