Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | VCAM1 | P19320 | 5/20 | 0.34 |
| ▸ | POLB | P06746 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | GALR2 | O43603 | 1/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8542930 | 0.83 | VCAM1 (0.38) | THRBVCAM1POLBHTTALDH1A1 | |
| SCHEMBL8538668 | 0.83 | PDK1 (0.36) | PDK1THRBVCAM1POLBHTT | |
| SCHEMBL8540482 | 0.83 | PDK1 (0.39) | PDK1VCAM1POLBHTTALDH1A1 | |
| SCHEMBL27358004 | 0.82 | PDK1 (0.39) | PDK1THRBVCAM1POLBHTT | |
| SCHEMBL7073207 | 0.81 | SLC9A1 (0.41) | — | |
| SCHEMBL8542635 | 0.81 | TXNRD1 (0.36) | PDK1THRBVCAM1HTTALDH1A1 | |
| SCHEMBL8542407 | 0.81 | PDK1 (0.38) | PDK1VCAM1HTTALDH1A1HPGD | |
| SCHEMBL8537184 | 0.81 | TXNRD1 (0.39) | PDK1THRBVCAM1ALDH1A1KMT2A | |
| SCHEMBL8539439 | 0.80 | TXNRD1 (0.44) | PDK1THRBVCAM1MAPT | |
| SCHEMBL8542295 | 0.80 | KIF18A (0.52) | PDK1POLBHTTKMT2ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5744641-A | Sulfonyl- or sulfinylbenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-04-28 | — | — | US | disclosed |