Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A1 | P22736 | 1/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11445975 | 0.83 | NR4A1 (0.51) | NR4A1MRGPRX4ALDH1A1KDM4ENPC1 | |
| Hydrochloric Acid SCHEMBL11725673 | 0.82 | ABCB11 (0.50) | NR4A1MRGPRX4ALDH1A1KDM4ENPC1 | |
| SCHEMBL11858604 | 0.78 | NR4A1 (0.49) | NR4A1MRGPRX4ALDH1A1KDM4ENPC1 | |
| SCHEMBL11725662 | 0.78 | NR4A1 (0.47) | NR4A1MRGPRX4ALDH1A1KDM4ENPC1 | |
| SCHEMBL11565682 | 0.77 | ALDH1A1 (0.42) | PPARGPPARAALDH1A1KDM4EHTT | |
| SCHEMBL11772462 | 0.77 | NR4A1 (0.46) | NR4A1MRGPRX4ALDH1A1KDM4ENPC1 | |
| SCHEMBL11725138 | 0.77 | NR4A1 (0.46) | NR4A1MRGPRX4ALDH1A1KDM4ENPC1 | |
| SCHEMBL5311586 | 0.76 | NR4A1 (0.47) | NR4A1MRGPRX4ALDH1A1KDM4ENPC1 | |
| SCHEMBL11853625 | 0.76 | NR4A1 (0.45) | NR4A1MRGPRX4ALDH1A1KDM4ENPC1 | |
| SCHEMBL11725583 | 0.76 | NR4A1 (0.45) | NR4A1MRGPRX4ALDH1A1KDM4ENPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-3995056-A | Butyric acid derivatives for treating pain and inflammation | ROUSSEL-UCLAF (FR) | 1976-11-30 | — | — | US | disclosed |
| US-3931302-A | ANTIINFLAMMATORY, ANALGESIC | ROUSSEL-UCLAF (FR) | 1976-01-06 | — | — | US | disclosed |