Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.78 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.78 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.57 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.57 |
| ▸ | ITGAL | P20701 | 1/20 | 0.57 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | NLN | Q9BYT8 | 1/20 | 0.51 |
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 SCHEMBL27702202 | 0.92 | CYP3A4 (0.78) | CYP3A4SLC7A5ITGB2ICAM1ITGAL | |
| Histidine SCHEMBL28093400 | 0.88 | CYP3A4 (0.93) | CYP3A4SLC7A5 | |
| D-Histidine SCHEMBL288043 | 0.88 | CYP3A4 (1.00) | CYP3A4SLC7A5 | |
| Histidine SCHEMBL388560 | 0.88 | CYP3A4 (1.00) | CYP3A4SLC7A5 | |
| Histidine SCHEMBL28071764 | 0.88 | CYP3A4 (1.00) | CYP3A4SLC7A5 | |
| Histidine SCHEMBL30852263 | 0.88 | CYP3A4 (1.00) | CYP3A4SLC7A5 | |
| Histidine SCHEMBL19974306 | 0.88 | CYP3A4 (1.00) | CYP3A4SLC7A5 | |
| Histidine SCHEMBL3260 | 0.88 | CYP3A4 (1.00) | CYP3A4SLC7A5 | |
| Histidine SCHEMBL137600 | 0.88 | CYP3A4 (1.00) | CYP3A4SLC7A5 | |
| Phenylalanine SCHEMBL28074950 | 0.87 | SLC7A5 (0.80) | CYP3A4SLC7A5HIF1ANLN |
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-85105655-A | Process for preparing novel derivatives of 1-methyl-4, 5-dihydroorotic acid and pharmaceutical compositions thereof | — | 1987-01-28 | — | — | CN | disclosed |