Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Histidine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Histidine SCHEMBL18280908 | 0.86 | CYP3A4 (0.30) | — | |
| Histidine SCHEMBL27660746 | 0.85 | SLC7A5 (0.31) | — | |
| Histidine SCHEMBL7763229 | 0.85 | — | — | |
| Histidine SCHEMBL19809592 | 0.83 | — | — | |
| Proline SCHEMBL1543509 | 0.83 | — | — | |
| Phenylalanine SCHEMBL294177 | 0.82 | REN (0.33) | — | |
| Histidine SCHEMBL3088582 | 0.82 | CYP3A4 (0.32) | — | |
| Histidine SCHEMBL1675273 | 0.82 | CYP3A4 (0.32) | — | |
| Histidine SCHEMBL790243 | 0.82 | CYP3A4 (0.32) | — | |
| Histidine SCHEMBL3490081 | 0.82 | CYP3A4 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1096257-A2 | Method, device and dye labelled peptide for the detection of molecules | Sauer, Markus (DE) | 2001-05-02 | — | — | EP | disclosed |