Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.37 |
| ▸ | HPGD | P15428 | 7/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | FHIT | P49789 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8050700 | 0.79 | ALDH1A1 (0.36) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL7515278 | 0.77 | HPGD (0.33) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL7524077 | 0.71 | ALDH1A1 (0.39) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL8045748 | 0.67 | TDP2 (0.35) | KMT2AKDM4ELMNAMEN1 | |
| SCHEMBL7521891 | 0.66 | HPGD (0.36) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL8206529 | 0.63 | HPGD (0.34) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL8053610 | 0.63 | HPGD (0.36) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL7514575 | 0.63 | CYP3A4 (0.45) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL8930717 | 0.63 | ALDH1A1 (0.39) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 | |
| SCHEMBL11008658 | 0.62 | ALDH1A1 (0.62) | ALDH1A1HPGDGAAMAPTSMN1; SMN2 |
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-0832054-B1 | HETEROCYCLIC METHYL FREE RADICALS AS IMAGE ENHANCING AGENTS | NYCOMED IMAGING AS (NO) | 2000-12-27 | — | — | EP | disclosed |
| US-6063360-A | USEFUL AS CONTRAST AGENT FOR OVERHAUSER MAGNETIC RESONACE IMAGING | NYCOMED IMAGING A/S (NO) | 2000-05-16 | — | — | US | disclosed |
| WO-1996039367-A1 | HETEROCYCLIC METHYL FREE RADICALS AS IMAGE ENHANCING AGENTS | NYCOMED IMAGING A/S (NO) | 1996-12-12 | — | — | WO | disclosed |