Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.61 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.61 |
| ▸ | ACMSD | Q8TDX5 | 3/20 | 0.51 |
| ▸ | HNF4A | P41235 | 2/20 | 0.51 |
| ▸ | DHFR | P00374 | 1/20 | 0.51 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.51 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | RXRA | P19793 | 1/20 | 0.47 |
| ▸ | RXRB | P28702 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10612209 | 0.90 | ALDH1A1 (0.53) | PDCD1CD274MCL1PTPN1CA12 | |
| SCHEMBL27552364 | 0.82 | NR4A2 (0.56) | ACMSDHNF4ADHFRMCL1PTPN1 | |
| SCHEMBL629105 | 0.82 | ACMSD (0.59) | ACMSDHNF4ADHFRMCL1PTPN1 | |
| SCHEMBL301544 | 0.81 | ALDH1A1 (0.58) | PDCD1CD274PTPN1CA12CA1 | |
| SCHEMBL29480096 | 0.81 | ALDH1A1 (0.58) | PDCD1CD274PTPN1CA12CA1 | |
| SCHEMBL30788746 | 0.81 | ALDH1A1 (0.58) | PDCD1CD274PTPN1CA12CA1 | |
| SCHEMBL7673881 | 0.80 | ACMSD (0.61) | ACMSDHNF4ADHFRMCL1PTPN1 | |
| SCHEMBL30616786 | 0.79 | ACMSD (0.70) | ACMSDHNF4ADHFRMCL1PTPN1 | |
| SCHEMBL68982 | 0.79 | ACMSD (0.70) | ACMSDHNF4ADHFRMCL1PTPN1 | |
| SCHEMBL9730821 | 0.79 | CA12 (0.51) | PDCD1CD274CA12CA1CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1140072-A4 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORP (US) | 2003-04-16 | — | — | EP | disclosed |
| EP-1140072-A1 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000040239-A1 | COMPOUNDS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2000-07-13 | — | — | WO | disclosed |