Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR5 | P32302 | 1/20 | 0.54 |
| ▸ | RARB | P10826 | 1/20 | 0.51 |
| ▸ | PLK1 | P53350 | 5/20 | 0.49 |
| ▸ | KAT8 | Q9H7Z6 | 4/20 | 0.49 |
| ▸ | BID | P55957 | 3/20 | 0.49 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.49 |
| ▸ | PPARA | Q07869 | 3/20 | 0.49 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.49 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.49 |
| ▸ | PPARG | P37231 | 2/20 | 0.49 |
| ▸ | EP300 | Q09472 | 1/20 | 0.49 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.49 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.49 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.49 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | PLK3 | Q9H4B4 | 3/20 | 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL7716826 | 0.98 | CXCR5 (0.53) | CXCR5RARBPLK1KAT8BID | |
| Ammonia Solution, Strong SCHEMBL7716827 | 0.98 | CXCR5 (0.53) | CXCR5RARBPLK1KAT8BID | |
| Ethylamine SCHEMBL7717891 | 0.95 | CXCR5 (0.51) | CXCR5RARBPLK1KAT8BID | |
| SCHEMBL6859420 | 0.93 | KDM4E (0.52) | CXCR5RARBPLK1KDM4EALDH1A1 | |
| SCHEMBL27944047 | 0.91 | KAT8 (0.53) | RARBPLK1KAT8BIDMCL1 | |
| SCHEMBL27944035 | 0.91 | KAT8 (0.53) | RARBPLK1KAT8BIDMCL1 | |
| SCHEMBL27944038 | 0.91 | KAT8 (0.53) | RARBPLK1KAT8BIDMCL1 | |
| SCHEMBL8757448 | 0.91 | KAT8 (0.53) | RARBPLK1KAT8BIDMCL1 | |
| SCHEMBL14836221 | 0.91 | KAT8 (0.53) | RARBPLK1KAT8BIDMCL1 | |
| SCHEMBL27924694 | 0.91 | KAT8 (0.53) | RARBPLK1KAT8BIDMCL1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1354887-B1 | Ligands for metals and improved metal-catalyzed processes based thereon | MASSACHUSETTS INST TECHNOLOGY (US) | 2007-04-25 | — | — | EP | disclosed |
| EP-1097158-B1 | LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES | MASSACHUSETTS INST TECHNOLOGY (US) | 2006-01-25 | — | — | EP | disclosed |
| EP-1354887-A1 | Ligands for metals and improved metal-catalyzed processes based thereon | Massachusetts Insitute of Technology (US) | 2003-10-22 | — | — | EP | disclosed |
| EP-1097158-A2 | LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2001-05-09 | — | — | EP | disclosed |
| WO-2000002887-A2 | LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2000-01-20 | — | — | WO | disclosed |