Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.52 |
| ▸ | MAOB | P27338 | 4/20 | 0.48 |
| ▸ | XDH | P47989 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | TACR2 | P21452 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8881676 | 0.89 | PPIA (0.49) | MRGPRX4MAOBCYP2C9CYP2C19KMT2A | |
| SCHEMBL8883572 | 0.89 | RXRA (0.48) | MRGPRX4MAOBCYP2C9CYP2C19P2RY12 | |
| SCHEMBL8885115 | 0.88 | MAOB (0.54) | MRGPRX4MAOBCYP2C9CYP2C19TDP1 | |
| SCHEMBL8883579 | 0.88 | MAOB (0.48) | MRGPRX4MAOBXDHCYP2C9CYP2C19 | |
| SCHEMBL8883498 | 0.88 | MAOB (0.48) | MAOBXDHCYP2C9CYP2C19NR4A2 | |
| SCHEMBL8882346 | 0.87 | MRGPRX4 (0.49) | MRGPRX4XDHNR4A2ALDH1A1 | |
| SCHEMBL8884599 | 0.86 | MRGPRX4 (0.60) | MRGPRX4XDHNR4A2HDAC8HDAC1 | |
| SCHEMBL8882407 | 0.85 | MAOB (0.62) | MRGPRX4MAOBCYP2C9CYP2C19PPARA | |
| SCHEMBL8881837 | 0.84 | MAOB (0.53) | MRGPRX4MAOBCYP2C9CYP2C19 | |
| SCHEMBL8881322 | 0.84 | MAOB (0.48) | MRGPRX4MAOBCYP2C9CYP2C19KMT2A |
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 |