Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPIA | P62937 | 3/20 | 0.49 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.48 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.48 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.48 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.48 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.48 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.48 |
| ▸ | GABRP | O00591 | 2/20 | 0.48 |
| ▸ | GABRD | O14764 | 2/20 | 0.48 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.48 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.48 |
| ▸ | GABRE | P78334 | 2/20 | 0.48 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.48 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.48 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.48 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 0.48 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8883498 | 0.89 | MAOB (0.48) | PPIAMAOBCYP2C9CYP2C19RXRA | |
| SCHEMBL8890310 | 0.89 | MRGPRX4 (0.52) | MAOBMRGPRX4CYP2C9CYP2C19KMT2A | |
| SCHEMBL8885115 | 0.89 | MAOB (0.54) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL8883579 | 0.89 | MAOB (0.48) | PPIAGABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL27404312 | 0.88 | TSHR (0.52) | MRGPRX4CYP2C9CYP2C19SMN1; SMN2HPGD | |
| SCHEMBL8881493 | 0.87 | TSHR (0.48) | MRGPRX4SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL8883572 | 0.87 | RXRA (0.48) | PPIAGABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL8882983 | 0.86 | LMNA (0.48) | MRGPRX4NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL8883328 | 0.86 | LMNA (0.48) | MRGPRX4NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL8882407 | 0.86 | MAOB (0.62) | MAOBMRGPRX4CYP2C9CYP2C19RXRA |
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 |