Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.59 |
| ▸ | CCR3 | P51677 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.51 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.50 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8538300 | 0.96 | GRIN2B (0.54) | SIGMAR1CCR3HRH3GRIN2B | |
| Hydrochloric Acid SCHEMBL8546852 | 0.95 | GRIN2B (0.53) | SIGMAR1CCR3HRH3GRIN2B | |
| SCHEMBL8545842 | 0.91 | CCR3 (0.56) | CCR3HRH3HMOX1 | |
| SCHEMBL8545836 | 0.91 | HRH3 (0.53) | SIGMAR1CCR3HRH3GRIN2B | |
| SCHEMBL8539454 | 0.89 | HRH3 (0.51) | SIGMAR1CCR3CYP2D6HRH3GRIN2B | |
| SCHEMBL9030985 | 0.88 | HRH3 (0.51) | SIGMAR1CCR3CYP2D6HRH3GRIN2B | |
| SCHEMBL8541020 | 0.85 | GRIN2B (0.55) | SIGMAR1CCR3MEN1TP53CYP1A2 | |
| SCHEMBL8540177 | 0.85 | CYP19A1 (0.49) | SIGMAR1HMOX1 | |
| SCHEMBL8544284 | 0.85 | CYP19A1 (0.49) | HMOX1 | |
| SCHEMBL8539162 | 0.83 | SLC6A2 (0.49) | KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0705258-B1 | AZOLYL-CYCLIC AMINE DERIVATIVES WITH IMMUNOMODULATORY ACTIVITY | KNOLL AG (DE) | 1998-12-30 | — | — | EP | disclosed |
| EP-0705258-A1 | AZOLYL-CYCLIC AMINE DERIVATIVES WITH IMMUNOMODULATORY ACTIVITY | Knoll AG (DE) | 1996-04-10 | — | — | EP | disclosed |
| WO-1995000507-A1 | AZOLYL-CYCLIC AMINE DERIVATIVES WITH IMMUNOMODULATORY ACTIVITY | KNOLL AG (DE) | 1995-01-05 | — | — | WO | disclosed |