Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | MRGPRX4 | Q96LA9 | 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 | |
|---|---|---|---|---|
| SCHEMBL8883328 | 1.00 | LMNA (0.48) | LMNATSHRALDH1A1CYP3A4MAPK1 | |
| SCHEMBL8881493 | 0.99 | TSHR (0.48) | LMNATSHRALDH1A1CYP3A4MAPK1 | |
| SCHEMBL27404312 | 0.96 | TSHR (0.52) | LMNATSHRALDH1A1CYP3A4MAPK1 | |
| SCHEMBL8885510 | 0.92 | LMNA (0.44) | LMNAALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL8883636 | 0.92 | LMNA (0.44) | LMNAALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL8881930 | 0.91 | LMNA (0.43) | LMNAALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL8882346 | 0.91 | MRGPRX4 (0.49) | LMNAALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL8883517 | 0.89 | XDH (0.43) | LMNAALDH1A1CNR2NPC1MAPT | |
| SCHEMBL8881676 | 0.86 | PPIA (0.49) | ALDH1A1NPC1MAPTRAB9AMRGPRX4 | |
| SCHEMBL8882561 | 0.85 | ESR1 (0.47) | LMNACNR2MAPTESR1AKR1C4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5658933-A | Substituted heterocyclic carboxamide esters, their preparation and their use as pharmaceuticals | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-08-19 | — | — | US | disclosed |