Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 7/20 | 0.50 |
| ▸ | AGTR2 | P50052 | 7/20 | 0.50 |
| ▸ | PPARG | P37231 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.44 |
| ▸ | TNF | P01375 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15560601 | 0.82 | TSHR (0.67) | AGTR1AGTR2PPARGMAPTTNF | |
| SCHEMBL6172771 | 0.78 | AGTR1 (0.62) | AGTR1AGTR2PPARGMAPTMEN1 | |
| SCHEMBL20266456 | 0.77 | GLP1R (0.51) | AGTR1AGTR2PPARGACSS2 | |
| SCHEMBL29281094 | 0.76 | LGALS8 (0.55) | PPARG | |
| SCHEMBL6168561 | 0.76 | AGTR1 (0.76) | AGTR1AGTR2PPARG | |
| SCHEMBL7671655 | 0.75 | AGTR1 (0.83) | AGTR1AGTR2PPARG | |
| SCHEMBL6169195 | 0.74 | TNF (0.62) | AGTR1AGTR2PPARGACSS2TNF | |
| SCHEMBL6168957 | 0.74 | AGTR1 (0.69) | AGTR1AGTR2PPARG | |
| SCHEMBL6167804 | 0.74 | PPARG (0.66) | AGTR1AGTR2PPARG | |
| SCHEMBL29149777 | 0.72 | GLP1R (0.50) | — |
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-104428293-B | Adjust the benzimidazole of TNF α | UCB生物制药私人有限公司 | 2018-06-08 | — | — | CN | disclosed |