Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | CTSS | P25774 | 2/20 | 0.46 |
| ▸ | CTSL | P07711 | 1/20 | 0.46 |
| ▸ | CTSB | P07858 | 1/20 | 0.46 |
| ▸ | CTSK | P43235 | 1/20 | 0.46 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL3957212 | 1.00 | ACE (0.48) | ACEKMT2ACYP3A4CYP2D6CYP2C9 | |
| SCHEMBL3957208 | 0.84 | SCN9A (0.58) | ACEKMT2AMEN1SIGMAR1CTSS | |
| SCHEMBL915402 | 0.80 | KMT2A (0.65) | KMT2AMEN1DRD4L3MBTL1SIGMAR1 | |
| SCHEMBL3635817 | 0.79 | KMT2A (0.56) | KMT2AMEN1DRD4L3MBTL1SIGMAR1 | |
| SCHEMBL3960093 | 0.78 | SIGMAR1 (0.56) | KMT2ACYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL2311994 | 0.77 | MEN1 (0.52) | KMT2ACYP2D6CYP2C9CYP2C19MEN1 | |
| SCHEMBL15809950 | 0.77 | KMT2A (0.62) | ACEKMT2ACYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7549641 | 0.77 | KCNA3 (0.59) | KMT2AMEN1DRD4L3MBTL1SIGMAR1 | |
| SCHEMBL1361202 | 0.77 | KMT2A (0.62) | ACEKMT2ACYP3A4CYP2D6CYP2C9 | |
| SCHEMBL3593211 | 0.76 | KDM4E (0.58) | KMT2AMEN1DRD4L3MBTL1SIGMAR1 |
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-6344449-B1 | HEADACHE AND MORPHINE DEPENDENCE | DR. KARL THOMAE GMBH (DE) | 2002-02-05 | — | — | US | disclosed |