Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 5/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774344 | 1.00 | SCN9A (0.36) | SCN9APKMHTTMEN1KMT2A | |
| SCHEMBL8774723 | 0.97 | MAPT (0.37) | SCN9AHTTKMT2AGAAMAPT | |
| SCHEMBL8774715 | 0.97 | MAPT (0.37) | SCN9AHTTKMT2AGAAMAPT | |
| SCHEMBL8774785 | 0.92 | SCN9A (0.38) | SCN9AHTTMEN1KMT2AHPGD | |
| SCHEMBL8774777 | 0.92 | SCN9A (0.38) | SCN9AHTTMEN1KMT2AHPGD | |
| SCHEMBL8774911 | 0.90 | PKM (0.38) | PKMHTTMEN1KMT2AGAA | |
| SCHEMBL8774918 | 0.90 | PKM (0.38) | PKMHTTMEN1KMT2AGAA | |
| SCHEMBL8774310 | 0.88 | HPGD (0.35) | SCN9AMEN1KMT2ANPC1HPGD | |
| SCHEMBL8774305 | 0.88 | HPGD (0.35) | SCN9AMEN1KMT2ANPC1HPGD | |
| SCHEMBL8775023 | 0.87 | PKM (0.36) | PKMHTTMEN1KMT2AGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |