Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA6 | P23280 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.38 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18682217 | 0.77 | TSHR (0.50) | TSHRTP53KDM4ECA12CA1 | |
| SCHEMBL18670700 | 0.77 | TSHR (0.50) | TSHRTP53KDM4ECA12CA1 | |
| SCHEMBL7388665 | 0.76 | ALDH1A1 (0.41) | KDM4EGAAPOLBMAPTL3MBTL1 | |
| SCHEMBL10170781 | 0.68 | SLC6A4 (0.50) | TSHRTP53KDM4ECA12CA1 | |
| SCHEMBL10148390 | 0.68 | RARG (0.56) | TSHRTP53KDM4ECA12CA1 | |
| SCHEMBL11169652 | 0.68 | SLC6A4 (0.50) | TSHRTP53KDM4ECA12CA1 | |
| Isophthalic Acid SCHEMBL689179 | 0.67 | CA12 (0.68) | TSHRTP53CA12CA1CA2 | |
| Isophthalic Acid SCHEMBL1963275 | 0.67 | CA12 (0.68) | TSHRTP53CA12CA1CA2 | |
| SCHEMBL24376354 | 0.66 | ACHE (0.50) | KDM4EPOLBMAPTALDH1A1KDM1A | |
| Terephthalic Acid SCHEMBL4607897 | 0.65 | TSHR (0.92) | TSHRTP53CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1196436-A2 | PEPTIDE BORONIC ACID INHIBITORS OF HEPATITIS C VIRUS PROTEASE | Bristol-Myers Squibb Pharma Company (US) | 2002-04-17 | — | — | EP | disclosed |
| WO-2001002424-A2 | PEPTIDE BORONIC ACID INHIBITORS OF HEPATITIS C VIRUS PROTEASE | DU PONT PHARMACEUTICALS COMPANY (US) | 2001-01-11 | — | — | WO | disclosed |