Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Tert-Butylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.32 |
| ▸ | CA1 | P00915 | 3/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.31 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.31 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30445858 | 0.92 | OPRM1 (0.36) | CA2CA1OPRM1SLC1A3SLC1A2 | |
| Ammonia Solution, Strong SCHEMBL7898017 | 0.90 | OPRM1 (0.34) | CA2CA1OPRM1 | |
| SCHEMBL14672608 | 0.86 | OPRM1 (0.44) | OPRM1SLC1A2SLC1A1 | |
| SCHEMBL27668193 | 0.84 | OPRM1 (0.43) | OPRM1 | |
| Dimethylamine SCHEMBL15955557 | 0.81 | OPRM1 (0.40) | OPRM1SLC1A2SLC1A1 | |
| SCHEMBL7009024 | 0.79 | — | — | |
| SCHEMBL17707034 | 0.74 | OPRM1 (0.31) | OPRM1 | |
| SCHEMBL4621867 | 0.74 | GSR (0.34) | — | |
| SCHEMBL18151479 | 0.74 | OPRM1 (0.39) | OPRM1 | |
| SCHEMBL8588077 | 0.73 | OPRM1 (0.37) | CA2CA1OPRM1SLC1A3SLC1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111655475-A | Metal-carbon fiber reinforced resin material composite and method for producing metal-carbon fiber reinforced resin material composite | 日本制铁株式会社 | 2020-09-11 | — | — | CN | disclosed |