Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PPARA | Q07869 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | PPARG | P37231 | 2/20 | 0.33 |
| ▸ | PPARD | Q03181 | 2/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL7737555 | 0.81 | PTGS1 (0.35) | PTGS1MEN1KMT2ATDP1CYP3A4 | |
| SCHEMBL7739194 | 0.79 | XDH (0.42) | PTGS1MEN1KMT2ATDP1CYP3A4 | |
| SCHEMBL7738425 | 0.79 | PTGS1 (0.44) | PTGS1MEN1KMT2ATDP1CYP3A4 | |
| SCHEMBL7737541 | 0.76 | PTGS1 (0.45) | PTGS1MEN1KMT2ATDP1CYP3A4 | |
| SCHEMBL7736596 | 0.73 | MEN1 (0.33) | MEN1KMT2AKDM4ELMNAMAPT | |
| SCHEMBL7732390 | 0.69 | PPARA (0.40) | PTGS1MEN1KMT2ATDP1CYP3A4 | |
| SCHEMBL7738413 | 0.68 | PPARA (0.36) | PTGS1MEN1KMT2ATDP1CYP3A4 | |
| SCHEMBL7739200 | 0.66 | PPARA (0.35) | PTGS1MEN1KMT2ATDP1CYP3A4 | |
| SCHEMBL7737533 | 0.65 | ALDH1A1 (0.41) | PTGS1MEN1KMT2ATDP1CYP3A4 | |
| SCHEMBL7732384 | 0.65 | XDH (0.44) | PTGS1MEN1KMT2ACYP3A4KDM4E |
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-6416861-B1 | COMBINATORIAL CHEMISTRY | NORTHWESTERN UNIVERSITY | 2002-07-09 | — | — | US | disclosed |
| WO-2000049022-A2 | ORGANOSILICON COMPOUNDS AND USES THEREOF | NORTHWESTERN UNIVERSITY (US) | 2000-08-24 | — | — | WO | disclosed |