Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | FDPS | P14324 | 1/20 | 0.50 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.49 |
| ▸ | ABAT | P80404 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 6/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TTR | P02766 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8085879 | 0.88 | ALDH1A1 (0.53) | ALDH1A1TSHRFDPSHPGDHTR2A | |
| SCHEMBL7344641 | 0.86 | ALDH1A1 (0.54) | ALDH1A1TSHRFDPSTRIM24HPGD | |
| SCHEMBL147148 | 0.83 | ALDH1A1 (0.54) | ALDH1A1TSHRFDPSTRIM24HPGD | |
| SCHEMBL27442782 | 0.83 | FDPS (0.55) | ALDH1A1TSHRFDPSTRIM24HPGD | |
| SCHEMBL5077090 | 0.82 | TSHR (0.46) | ALDH1A1TSHRTDP1ALOX5MEN1 | |
| SCHEMBL28228167 | 0.82 | TSHR (0.46) | ALDH1A1TSHRTDP1ALOX5MEN1 | |
| SCHEMBL13644446 | 0.82 | ALDH1A1 (0.66) | ALDH1A1TSHRFDPSTRIM24HPGD | |
| SCHEMBL30271611 | 0.82 | ALDH1A1 (0.66) | ALDH1A1TSHRFDPSTRIM24HPGD | |
| SCHEMBL29818813 | 0.80 | TYR (0.44) | ALDH1A1TSHRTDP1ALOX5MEN1 | |
| SCHEMBL36212 | 0.80 | TSHR (0.44) | ALDH1A1TSHRTDP1ALOX5MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6017916-A | Nonpeptide endothelin antagonists I | WARNER-LAMBERT COMPANY (US) | 2000-01-25 | — | — | US | disclosed |
| US-5691373-A | TREATING SUBARACHNOID HEMORRHAGE | WARNER-LAMBERT COMPANY (US) | 1997-11-25 | — | — | US | disclosed |
| EP-0714391-A1 | SUBSTITUTED 2(5H)FURANONE, 2(5H)THIOPHENONE AND 2(5H)PYRROLONE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ENDOTHELIN ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 1996-06-05 | — | — | EP | disclosed |
| WO-1995005376-A1 | SUBSTITUTED 2(5H)FURANONE, 2(5H)THIOPHENONE AND 2(5H)PYRROLONE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ENDOTHELIN ANTAGONISTS | WARNER-LAMBERT COMPANY (US) | 1995-02-23 | — | — | WO | disclosed |