Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL16632444 | 0.89 | GABRA1 (0.36) | GABRA1GABRB2 | |
| SCHEMBL16640280 | 0.80 | ESR1 (0.42) | GABRA1GABRB2 | |
| SCHEMBL16640275 | 0.80 | ESR1 (0.42) | GABRA1GABRB2 | |
| SCHEMBL7894971 | 0.78 | TDP1 (0.31) | — | |
| SCHEMBL7894972 | 0.78 | TDP1 (0.31) | — | |
| SCHEMBL7904039 | 0.78 | TDP1 (0.31) | — | |
| SCHEMBL16640279 | 0.78 | SLC6A2 (0.35) | — | |
| SCHEMBL2847943 | 0.75 | SLC6A2 (0.35) | GABRA1GABRB2 | |
| SCHEMBL18605828 | 0.75 | GABRA1 (0.32) | GABRA1GABRB2 | |
| SCHEMBL18280246 | 0.75 | GABRA1 (0.32) | GABRA1GABRB2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9815694-B2 | Catalytic ammonia synthesis by transition metal molecular complexes | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2017-11-14 | — | — | US | disclosed |
| US-20150104371-A1 | CATALYTIC AMMONIA SYNTHESIS BY TRANSITION METAL MOLECULAR COMPLEXES | CALIFORNIA INSTITUTE OF TECHNOLOGY | 2015-04-16 | — | — | US | disclosed |