Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.83 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.83 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.83 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | CNR2 | P34972 | 1/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | FPR2 | P25090 | 1/20 | 0.47 |
| ▸ | SCN4A | P35499 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | LDHA | P00338 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8056897 | 1.00 | CYP1A2 (0.83) | CYP1A2CYP2D6CYP2C19SLC6A4TDP1 | |
| SCHEMBL9564556 | 0.91 | CYP1A2 (1.00) | CYP1A2CYP2D6CYP2C19SLC6A4LDHA | |
| SCHEMBL12706131 | 0.91 | CYP1A2 (1.00) | CYP1A2CYP2D6CYP2C19SLC6A4LDHA | |
| SCHEMBL3734984 | 0.84 | CYP1A2 (0.58) | CYP1A2CYP2D6CYP2C19SLC6A4TDP1 | |
| SCHEMBL3734743 | 0.84 | CYP1A2 (0.58) | CYP1A2CYP2D6CYP2C19SLC6A4TDP1 | |
| SCHEMBL8066335 | 0.83 | CYP1A2 (0.83) | CYP1A2CYP2D6CYP2C19SLC6A4KMT2A | |
| SCHEMBL7039221 | 0.83 | CYP1A2 (0.83) | CYP1A2CYP2D6CYP2C19SLC6A4CNR2 | |
| SCHEMBL2368100 | 0.83 | CYP1A2 (0.83) | CYP1A2CYP2D6CYP2C19SLC6A4CNR2 | |
| SCHEMBL5680007 | 0.83 | CYP1A2 (0.83) | CYP1A2CYP2D6CYP2C19SLC6A4KMT2A | |
| SCHEMBL8619532 | 0.83 | CYP1A2 (0.57) | CYP1A2CYP2D6CYP2C19SLC6A4TDP1 |
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-0587670-A4 | PCP RECEPTOR LIGANDS AND THE USE THEREOF. | OREGON STATE (US) | 1995-02-01 | — | — | EP | disclosed |
| EP-0587670-A1 | PCP RECEPTOR LIGANDS AND THE USE THEREOF | STATE OF OREGON, acting through OREGON STATE BOARD OF HIGHER EDUCATION, acting for OREGON HEALTH SC. UNIV. AND UNIV. OF OREGON (US) | 1994-03-23 | — | — | EP | disclosed |