Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 3/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | TACR2 | P21452 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SHBG | P04278 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7756297 | 0.94 | HTT (0.36) | HTTHPGDALDH1A1HSD17B10PTGS2 | |
| SCHEMBL22465845 | 0.80 | HSD17B3 (0.44) | HTTHPGDALDH1A1HSD17B3CA2 | |
| SCHEMBL22465842 | 0.80 | HSD17B3 (0.44) | HTTHPGDALDH1A1HSD17B3CA2 | |
| SCHEMBL22465827 | 0.80 | HSD17B3 (0.44) | HTTHPGDALDH1A1HSD17B3CA2 | |
| SCHEMBL8478721 | 0.72 | HPGD (0.66) | HTTHPGDALDH1A1LMNACA2 | |
| SCHEMBL8476172 | 0.72 | HPGD (0.66) | HTTHPGDALDH1A1LMNACA2 | |
| SCHEMBL8474666 | 0.70 | HPGD (0.63) | HTTHPGDALDH1A1LMNACA2 | |
| SCHEMBL22465844 | 0.69 | EPHX2 (0.48) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL18843172 | 0.69 | EPHX2 (0.48) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL22465843 | 0.69 | EPHX2 (0.48) | ESR1ADRA2AADORA3TACR2SLC6A2 |
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-1077696-A1 | FURAN NITRONE THERAPEUTICS FOR THE TREATMENT OF INFLAMMATORY BOWEL DISEASE | CENTAUR PHARMACEUTICALS, INC. (US) | 2001-02-28 | — | — | EP | disclosed |
| WO-1999059579-A1 | FURAN NITRONE THERAPEUTICS FOR THE TREATMENT OF INFLAMMATORY BOWEL DISEASE | CENTAUR PHARMACEUTICALS, INC. (US) | 1999-11-25 | — | — | WO | disclosed |