Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28751480 | 0.88 | MAP4K4 (0.38) | CYP3A4MAOA | |
| SCHEMBL8717044 | 0.87 | ALDH1A1 (0.31) | CYP3A4TDP1 | |
| SCHEMBL28087954 | 0.86 | ALDH1A1 (0.30) | CYP3A4TDP1 | |
| SCHEMBL28779399 | 0.86 | ALDH1A1 (0.30) | CYP3A4TDP1 | |
| SCHEMBL28289587 | 0.86 | ALDH1A1 (0.30) | CYP3A4TDP1 | |
| SCHEMBL28754048 | 0.81 | IDO1 (0.33) | — | |
| SCHEMBL3107258 | 0.80 | HSD17B1 (0.38) | CYP3A4 | |
| SCHEMBL28557687 | 0.80 | RAB9A (0.33) | HSD17B10 | |
| SCHEMBL28327044 | 0.80 | IDO1 (0.33) | TAAR1 | |
| SCHEMBL27787556 | 0.80 | TAAR1 (0.35) | TAAR1CYP3A4HSD17B10TDP1 |
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-117229523-A | Ultrathin porphyrin-based benzamide derivative HOFs nano material and preparation method and application thereof | 河南大学 | 2023-12-15 | — | — | CN | claimed |
| CN-117229523-A | Ultrathin porphyrin-based benzamide derivative HOFs nano material and preparation method and application thereof | 河南大学 | 2023-12-15 | — | — | CN | disclosed |