Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 11/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 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 | |
|---|---|---|---|---|
| SCHEMBL124841 | 1.00 | PDK2 (0.50) | PDK2THRBTDP1AKR1A1AKR1B1 | |
| SCHEMBL29359326 | 1.00 | PDK2 (0.50) | PDK2THRBTDP1AKR1A1AKR1B1 | |
| SCHEMBL8539410 | 0.95 | THRB (0.55) | PDK2THRBTDP1AKR1A1AKR1B1 | |
| SCHEMBL29827101 | 0.92 | PDK2 (0.47) | PDK2AKR1A1AKR1B1GAASLC6A3 | |
| SCHEMBL1982326 | 0.92 | PDK2 (0.47) | PDK2AKR1A1AKR1B1GAASLC6A3 | |
| SCHEMBL2097489 | 0.91 | PDK2 (0.43) | PDK2THRBTDP1AKR1A1AKR1B1 | |
| SCHEMBL29663083 | 0.86 | THRB (0.59) | PDK2THRBTDP1GAAPOLB | |
| SCHEMBL3245527 | 0.86 | THRB (0.59) | PDK2THRBTDP1GAAPOLB | |
| SCHEMBL3956404 | 0.84 | PDK2 (0.38) | PDK2THRBTDP1AKR1A1AKR1B1 | |
| SCHEMBL9671734 | 0.82 | PDK2 (0.51) | PDK2THRBTDP1GAAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-5688745-A | Arylsulfonylureas and their use as herbicides and growth regulators | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-11-18 | — | — | US | disclosed |
| US-5463081-A | Chemical intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-10-31 | — | — | US | disclosed |