Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | FFAR1 | O14842 | 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 | |
|---|---|---|---|---|
| SCHEMBL316146 | 0.98 | THRB (0.32) | THRBTDP1AKR1C1TP53FFAR1 | |
| Hydrochloric Acid SCHEMBL8006256 | 0.97 | THRB (0.32) | THRBTDP1AKR1C1TP53FFAR1 | |
| SCHEMBL21328421 | 0.97 | THRB (0.32) | THRBTDP1AKR1C1TP53FFAR1 | |
| Hydrochloric Acid SCHEMBL2219432 | 0.97 | THRB (0.32) | THRBTDP1AKR1C1TP53FFAR1 | |
| Water SCHEMBL28074687 | 0.95 | THRB (0.31) | THRBTDP1AKR1C1 | |
| Biphenyl SCHEMBL9775373 | 0.95 | TP53 (0.33) | THRBTDP1TP53FFAR1 | |
| SCHEMBL27561056 | 0.95 | TP53 (0.36) | TP53FFAR1 | |
| Anthracene SCHEMBL28212238 | 0.91 | ACMSD (0.33) | — | |
| SCHEMBL6808145 | 0.89 | MAPT (0.33) | — | |
| SCHEMBL8973050 | 0.88 | RAB9A (0.44) | AKR1C1 |
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-108947801-A | 4- chlorobenzoic acid prepares biphenyl dicarboxylic acid in ionic liquid | 青岛科技大学 | 2018-12-07 | — | — | CN | disclosed |