Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.41 |
| ▸ | CPB2 | Q96IY4 | 3/20 | 0.41 |
| ▸ | CPB1 | P15086 | 1/20 | 0.41 |
| ▸ | CPA1 | P15085 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.39 |
| ▸ | GABRR2 | P28476 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6662834 | 0.82 | TP53 (0.43) | TP53SMN1; SMN2NPC1RAB9ACYP3A4 | |
| SCHEMBL5163320 | 0.79 | AOC1 (0.43) | TP53SMN1; SMN2NPC1RAB9ACYP3A4 | |
| SCHEMBL6670423 | 0.76 | HRH3 (0.42) | TP53SMN1; SMN2NPC1RAB9ACYP3A4 | |
| 4-Imidazolecarboxylic Acid SCHEMBL27315802 | 0.76 | — | — | |
| SCHEMBL19234747 | 0.75 | AOC1 (0.46) | TP53SMN1; SMN2NPC1RAB9ACYP3A4 | |
| SCHEMBL6664871 | 0.74 | AOC1 (0.42) | TP53SMN1; SMN2NPC1RAB9ACYP3A4 | |
| 4-Imidazolecarboxylic Acid SCHEMBL317725 | 0.73 | — | — | |
| SCHEMBL10352986 | 0.73 | NPC1 (0.42) | TP53SMN1; SMN2NPC1RAB9ACYP3A4 | |
| SCHEMBL890216 | 0.71 | — | — | |
| 4-Imidazolecarboxylic Acid SCHEMBL27484959 | 0.71 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109206517-A | ST2 antigen-binding proteins | 安进公司 | 2019-01-15 | — | — | CN | disclosed |
| EP-1340746-B1 | Process for the reduction of 3-heteroaryl-3-oxo-propanoic acid derivatives | SALTIGO GMBH (DE) | 2007-02-28 | — | — | EP | disclosed |
| EP-1340746-A1 | Process for the reduction of 3-heteroaryl-3-oxo-propanoic acid derivatives | BAYER AG (DE) | 2003-09-03 | — | — | EP | disclosed |