Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CCR2 | P41597 | 4/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.33 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.33 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8567902 | 1.00 | CYP2C9 (0.53) | CYP2C9MAPTALDH1A1LMNAMEN1 | |
| SCHEMBL8572819 | 0.93 | CYP2C9 (0.45) | CYP2C9MAPTALDH1A1LMNAMEN1 | |
| SCHEMBL8572821 | 0.93 | CYP2C9 (0.45) | CYP2C9MAPTALDH1A1LMNAMEN1 | |
| SCHEMBL8570193 | 0.92 | CYP2C9 (0.44) | CYP2C9MAPTALDH1A1LMNAMEN1 | |
| SCHEMBL8570189 | 0.92 | CYP2C9 (0.44) | CYP2C9MAPTALDH1A1LMNAMEN1 | |
| SCHEMBL8052168 | 0.91 | CYP2C9 (0.56) | CYP2C9MAPTALDH1A1LMNAMEN1 | |
| SCHEMBL8025496 | 0.91 | CYP2C9 (0.56) | CYP2C9MAPTALDH1A1LMNAMEN1 | |
| SCHEMBL8569487 | 0.91 | CYP2C9 (0.40) | CYP2C9MAPTALDH1A1LMNAMEN1 | |
| SCHEMBL8569491 | 0.91 | CYP2C9 (0.40) | CYP2C9MAPTALDH1A1LMNAMEN1 | |
| SCHEMBL11035897 | 0.88 | CYP2C9 (0.53) | CYP2C9MAPTALDH1A1LMNAMEN1 |
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-5716543-A | GOOD TEMPERATURE BEHAVIOR OF NEMATIC PHASE; SOLUBILITY | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-02-10 | — | — | US | disclosed |