Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.30 |
| ▸ | KDM4A | O75164 | 1/20 | 0.30 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.30 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20187624 | 0.87 | HSD17B10 (0.37) | ALDH1A1MEN1KMT2AKDM4EMDM2 | |
| SCHEMBL20200024 | 0.84 | KDM4E (0.43) | ALDH1A1MEN1KMT2AKDM4EMDM2 | |
| SCHEMBL24186561 | 0.84 | — | — | |
| SCHEMBL20187511 | 0.82 | CA1 (0.33) | ALDH1A1KDM4EMDM2CA12CA1 | |
| SCHEMBL20199971 | 0.81 | ALDH1A1 (0.35) | ALDH1A1KDM4EMDM2SMN1; SMN2SIGMAR1 | |
| SCHEMBL20199840 | 0.80 | TACR1 (0.32) | ALDH1A1MEN1KMT2ATACR1SMN1; SMN2 | |
| SCHEMBL20200037 | 0.78 | BLM (0.35) | ALDH1A1KMT2AKDM4EMDM2TACR1 | |
| SCHEMBL24186640 | 0.78 | — | — | |
| SCHEMBL20200052 | 0.78 | ALDH1A1 (0.37) | ALDH1A1MEN1KMT2AKDM4EMDM2 | |
| SCHEMBL20187535 | 0.77 | PLA2G10 (0.35) | ALDH1A1MEN1KMT2AKDM4ECA12 |
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-3544964-B1 | HIGH RELAXIVITY GADOLINIUM CHELATE COMPOUNDS FOR USE IN MAGNETIC RESONANCE IMAGING | Bayer Pharma AG (DE) | 2020-06-17 | — | — | EP | disclosed |
| WO-2018096082-A1 | HIGH RELAXIVITY GADOLINIUM CHELATE COMPOUNDS FOR USE IN MAGNETIC RESONANCE IMAGING | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-31 | — | — | WO | disclosed |