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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 1/20 | 0.54 |
| ▸ | LCK | P06239 | 1/20 | 0.54 |
| ▸ | FYN | P06241 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | FDPS | P14324 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | GGT1 | P19440 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Tert-Butylamine SCHEMBL289315 | 0.96 | — | — | |
| Tert-Butylamine SCHEMBL27717339 | 0.96 | FFAR3 (0.58) | FFAR3LCKFYNTSHRALDH1A1 | |
| Acetic Acid SCHEMBL29475783 | 0.88 | FFAR3 (0.58) | FFAR3LCKFYNTSHRALDH1A1 | |
| Acetic Acid SCHEMBL5526727 | 0.85 | FFAR3 (0.54) | FFAR3LCKFYNTSHRALDH1A1 | |
| Acetic Acid SCHEMBL28916538 | 0.85 | FFAR3 (0.54) | FFAR3LCKFYNTSHRALDH1A1 | |
| Tert-Butylamine SCHEMBL4062442 | 0.84 | — | — | |
| Tert-Butylamine SCHEMBL14836204 | 0.84 | ALDH1A1 (0.47) | FFAR3LCKFYNTSHRALDH1A1 | |
| Tert-Butylamine SCHEMBL362032 | 0.84 | — | — | |
| Acetic Acid SCHEMBL3731603 | 0.84 | FFAR3 (0.64) | FFAR3LCKFYNTSHRALDH1A1 | |
| Acetic Acid SCHEMBL442452 | 0.81 | FFAR3 (0.50) | FFAR3LCKFYNTSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116217655-A | Preparation method of intermediate of linker drug conjugate | 上海复旦张江生物医药股份有限公司 | 2023-06-06 | — | — | CN | disclosed |
| CN-116178386-A | Preparation method of linker drug conjugate and intermediate thereof | 上海复旦张江生物医药股份有限公司 | 2023-05-30 | — | — | CN | disclosed |