Known targets — ChEMBL curated mechanism
PPARDPTGS1PTGS2dacAdacBdacCftsImrcAmrcBmrdA
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.
Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.74 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.74 |
| ▸ | CPB2 | Q96IY4 | 4/20 | 0.64 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.56 |
| ▸ | CPB1 | P15086 | 1/20 | 0.54 |
| ▸ | GSR | P00390 | 1/20 | 0.53 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Histidine SCHEMBL27986330 | 0.99 | CYP3A4 (0.76) | CYP3A4SLC7A5CPB2SLC15A2CPB1 | |
| Histidine SCHEMBL2228758 | 0.87 | CYP3A4 (0.97) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL3985699 | 0.87 | CYP3A4 (0.97) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL16893960 | 0.87 | CYP3A4 (0.97) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL5134199 | 0.87 | CYP3A4 (0.97) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL209484 | 0.87 | CYP3A4 (0.97) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| D-Histidine SCHEMBL8002459 | 0.87 | CYP3A4 (0.97) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL28338886 | 0.87 | CYP3A4 (0.74) | CYP3A4SLC7A5CPB2SLC15A2CPB1 | |
| D-Histidine SCHEMBL3639231 | 0.86 | CYP3A4 (0.93) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL31618930 | 0.86 | CYP3A4 (0.93) | CYP3A4SLC7A5CPB2HRH4HRH3 |
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-107751999-A | A kind of formula powder for isovaleric acidemia and preparation method thereof | 赤峰赛佰诺制药有限公司 | 2018-03-06 | — | — | CN | disclosed |
| CN-107751996-A | A kind of formula powder for urea cycle disorder and preparation method thereof | 赤峰赛佰诺制药有限公司 | 2018-03-06 | — | — | CN | disclosed |