Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 5/20 | 0.60 |
| ▸ | XDH | P47989 | 1/20 | 0.56 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | RXRA | P19793 | 2/20 | 0.49 |
| ▸ | RXRB | P28702 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.48 |
| ▸ | RHEB | Q15382 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | RXRG | P48443 | 1/20 | 0.47 |
| ▸ | KDM5A | P29375 | 1/20 | 0.46 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.46 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8881727 | 0.87 | MEN1 (0.54) | MRGPRX4XDHNR4A2HPGDRXRA | |
| SCHEMBL8890310 | 0.86 | MRGPRX4 (0.52) | MRGPRX4XDHNR4A2HDAC8HDAC1 | |
| SCHEMBL8882968 | 0.86 | XDH (0.56) | MRGPRX4XDHNR4A2HPGDRXRA | |
| SCHEMBL8885039 | 0.85 | RXRA (0.58) | MRGPRX4XDHHPGDRXRARXRB | |
| SCHEMBL8885049 | 0.84 | MRGPRX4 (0.45) | MRGPRX4XDHHPGDRXRARXRB | |
| SCHEMBL8883109 | 0.83 | RXRA (0.58) | MRGPRX4RXRARXRBRXRGKDM5A | |
| SCHEMBL8881217 | 0.82 | MRGPRX4 (0.47) | MRGPRX4XDHNR4A2HDAC8RAB9A | |
| SCHEMBL8882346 | 0.81 | MRGPRX4 (0.49) | MRGPRX4XDHNR4A2NPC1RAB9A | |
| SCHEMBL27426334 | 0.80 | MRGPRX4 (0.56) | MRGPRX4HDAC8HPGDRXRANPC1 | |
| SCHEMBL10709903 | 0.80 | PLAU (0.58) | MRGPRX4HPGDRXRARXRBNPC1 |
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-5658933-A | Substituted heterocyclic carboxamide esters, their preparation and their use as pharmaceuticals | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-08-19 | — | — | US | disclosed |
| CN-1107144-A | Substituted heterocyclic carboxamide esters, their preparation and their use as pharmaceuticals | HOECHST AG (DE) | 1995-08-23 | — | — | CN | disclosed |