Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 3/20 | 0.55 |
| ▸ | CCR5 | P51681 | 3/20 | 0.55 |
| ▸ | CCR8 | P51685 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | ALPL | P05186 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | ALPI | P09923 | 1/20 | 0.50 |
| ▸ | ALPG | P10696 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| 4-Mercaptopyridine SCHEMBL7785225 | 0.92 | CCR1 (0.47) | CCR1CCR5CCR8KDM4ETP53 | |
| 2-Mercaptopyrimidine SCHEMBL7794551 | 0.87 | CCR1 (0.60) | CCR1CCR5CCR8KDM4ETP53 | |
| SCHEMBL1993385 | 0.87 | CCR1 (0.72) | CCR1CCR5CCR8KDM4ETP53 | |
| SCHEMBL8526623 | 0.82 | CCR1 (0.62) | CCR1CCR5CCR8KDM4ETP53 | |
| SCHEMBL913279 | 0.80 | CCR1 (0.70) | CCR1CCR5CCR8KDM4ETP53 | |
| SCHEMBL29577140 | 0.80 | CCR1 (0.70) | CCR1CCR5CCR8KDM4ETP53 | |
| Terpyridine SCHEMBL7790809 | 0.77 | KDM4E (0.53) | CCR1CCR5CCR8KDM4ETP53 | |
| 4-Mercaptopyridine SCHEMBL7790653 | 0.75 | CYP2D6 (0.49) | CCR1CCR5CCR8KDM4ETP53 | |
| 4-Mercaptopyridine SCHEMBL7795235 | 0.74 | CYP2D6 (0.44) | CCR1CCR5CCR8KDM4ETP53 | |
| SCHEMBL4889156 | 0.73 | CCR1 (0.77) | CCR1CCR5CCR8KDM4ETP53 |
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-1155025-A1 | PLATINUM (II) COMPOUNDS | ISIS INNOVATION LIMITED (GB) | 2001-11-21 | — | — | EP | claimed |
| WO-2000050431-A1 | PLATINUM (II) COMPOUNDS | ISIS INNOVATION LIMITED (GB) | 2000-08-31 | — | — | WO | claimed |