Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 9/20 | 0.47 |
| ▸ | CA1 | P00915 | 7/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.38 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.38 |
| ▸ | ITGAL | P20701 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | GRN | P28799 | 1/20 | 0.36 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | TYMS | P04818 | 2/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | TMPRSS15 | P98073 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6508607 | 0.91 | KDM4E (0.47) | CA2CA1KDM4EHPGDDHFR | |
| SCHEMBL6512041 | 0.89 | CA2 (0.47) | CA2CA1MRGPRX4KMT2AKDM4E | |
| SCHEMBL6511464 | 0.86 | CA2 (0.49) | CA2CA1MRGPRX4KMT2AKDM4E | |
| SCHEMBL6509680 | 0.84 | CA2 (0.46) | CA2CA1MRGPRX4KMT2AKDM4E | |
| SCHEMBL4397295 | 0.79 | KDM4E (0.47) | CA2CA1KDM4EHPGDDHFR | |
| SCHEMBL6510663 | 0.79 | KDM4E (0.47) | CA2CA1KDM4EHPGDDHFR | |
| SCHEMBL6509910 | 0.76 | KDM4E (0.40) | CA2CA1KDM4EHPGDDHFR | |
| SCHEMBL6509677 | 0.75 | KDM4E (0.46) | CA2CA1KDM4EHPGDDHFR | |
| SCHEMBL16145009 | 0.75 | CA2 (0.61) | CA2CA1MRGPRX4KMT2AKDM4E | |
| SCHEMBL16145008 | 0.75 | CA2 (0.61) | CA2CA1MRGPRX4KMT2AKDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1165493-B1 | NITROGEN MUSTARD COMPOUNDS AND PRODRUGS THEREFOR | CANCER REC TECH LTD (GB) | 2005-01-19 | — | — | EP | claimed |