Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 11/20 | 0.60 |
| ▸ | AKR1C2 | P52895 | 11/20 | 0.60 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.60 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.60 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.49 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.49 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.48 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL26093138 | 0.89 | AKR1C3 (0.61) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL3828059 | 0.89 | AKR1C3 (0.65) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL5371516 | 0.86 | ACHE (0.46) | AKR1C3AKR1C2AKR1C1PTGS1TAS1R3 | |
| SCHEMBL15804459 | 0.86 | AKR1C3 (0.54) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL10779075 | 0.84 | AKR1C3 (0.49) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL2495059 | 0.83 | AKR1C3 (0.58) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL298386 | 0.83 | TSHR (0.67) | AKR1C3AKR1C2AKR1C1PTGS1ACHE | |
| SCHEMBL2656910 | 0.82 | AKR1C3 (0.55) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL15762734 | 0.81 | AKR1C3 (0.49) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 | |
| SCHEMBL15804463 | 0.81 | AKR1C3 (0.49) | AKR1C3AKR1C2AKR1C1PTGS1AKR1B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0862550-B1 | CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE | BASF AG (DE) | 2000-11-08 | — | — | EP | disclosed |