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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCK | P35557 | 20/20 | 0.47 |
| ▸ | RARG | P13631 | 1/20 | 0.44 |
| ▸ | RARA | P10276 | 1/20 | 0.43 |
| ▸ | RARB | P10826 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL320803 | 0.94 | GCK (0.50) | GCKRARGRARARARB | |
| SCHEMBL2654383 | 0.94 | GCK (0.50) | GCKRARGRARARARB | |
| SCHEMBL320840 | 0.93 | GCK (0.49) | GCKRARGRARARARB | |
| SCHEMBL1107734 | 0.85 | GCK (0.57) | GCKRARGRARARARB | |
| SCHEMBL2668926 | 0.85 | GCK (0.41) | GCKRARGRARARARB | |
| SCHEMBL2088534 | 0.82 | CA12 (0.54) | GCKRARGRARARARB | |
| SCHEMBL320646 | 0.82 | CA12 (0.54) | GCKRARGRARARARB | |
| SCHEMBL1426494 | 0.82 | CA12 (0.54) | GCKRARGRARARARB | |
| SCHEMBL1107709 | 0.81 | GCK (0.55) | GCKRARGRARARARB | |
| SCHEMBL1107706 | 0.81 | GCK (0.63) | GCKRARGRARARARB |
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-8093252-B2 | Crystalline polymorphic form of glucokinase activator | ASTRAZENECA AB (SE) | 2012-01-10 | — | — | US | disclosed |