Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.33 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TOP2A | P11388 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8046714 | 0.85 | ALDH1A1 (0.39) | ALDH1A1HSD17B10HPGDLMNASMN1; SMN2 | |
| SCHEMBL8719304 | 0.84 | ALDH1A1 (0.38) | ALDH1A1HSD17B10HPGDLMNASMN1; SMN2 | |
| SCHEMBL8035909 | 0.79 | ALDH1A1 (0.35) | ALDH1A1HSD17B10HPGDLMNASMN1; SMN2 | |
| SCHEMBL8048144 | 0.79 | ALDH1A1 (0.35) | ALDH1A1HSD17B10HPGDLMNASMN1; SMN2 | |
| SCHEMBL8930709 | 0.79 | ALDH1A1 (0.40) | ALDH1A1HSD17B10HPGDLMNASMN1; SMN2 | |
| SCHEMBL8035997 | 0.79 | ALDH1A1 (0.37) | ALDH1A1HSD17B10HPGDLMNASMN1; SMN2 | |
| SCHEMBL8930699 | 0.75 | ALDH1A1 (0.36) | ALDH1A1HSD17B10HPGDLMNASMN1; SMN2 | |
| SCHEMBL9268014 | 0.73 | ALDH1A1 (0.35) | ALDH1A1HSD17B10HPGDLMNASMN1; SMN2 | |
| SCHEMBL8208364 | 0.69 | ALDH1A1 (0.34) | ALDH1A1HSD17B10HPGDLMNASMN1; SMN2 | |
| SCHEMBL8210509 | 0.69 | ALDH1A1 (0.34) | ALDH1A1HSD17B10HPGDLMNASMN1; 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 4 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 |
| US-5530140-A | Free radicals | NYCOMED IMAGING AS (NO) | 1996-06-25 | — | — | US | disclosed |