Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.63 |
| ▸ | HRH1 | P35367 | 2/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.61 |
| ▸ | LTA4H | P09960 | 1/20 | 0.55 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.52 |
| ▸ | RARB | P10826 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | RARA | P10276 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MTOR | P42345 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL22386773 | 0.94 | LTA4H (0.59) | SIGMAR1HRH1KCNH2LTA4HGRIN2B | |
| SCHEMBL2741684 | 0.94 | LTA4H (0.59) | SIGMAR1HRH1KCNH2LTA4HGRIN2B | |
| Hydrochloric Acid SCHEMBL6596661 | 0.94 | LTA4H (0.59) | SIGMAR1HRH1KCNH2LTA4HGRIN2B | |
| Hydrochloric Acid SCHEMBL227403 | 0.92 | LTA4H (0.58) | SIGMAR1HRH1KCNH2LTA4HGRIN2B | |
| SCHEMBL7772142 | 0.88 | SLC6A3 (0.61) | SIGMAR1KCNH2HRH3CYP1A2CYP3A4 | |
| SCHEMBL2741683 | 0.87 | HRH3 (0.62) | SIGMAR1KCNH2HRH3CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL7447525 | 0.87 | SLC6A3 (0.59) | SIGMAR1KCNH2HRH3CYP1A2CYP3A4 | |
| SCHEMBL7031548 | 0.87 | HRH3 (0.62) | SIGMAR1KCNH2HRH3CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL223935 | 0.85 | HRH3 (0.61) | SIGMAR1HRH3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10899639 | 0.84 | SIGMAR1 (0.66) | SIGMAR1HRH1KCNH2HRH3HTR2A |
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-1940823-A2 | SUBSTITUTED 1-AMINO-PHTHALZINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF | Sanofi-Aventis (FR) | 2008-07-09 | — | — | EP | disclosed |
| WO-2007042660-A2 | SUBSTITUTED 1-AMINO-PHTHALZINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2007-04-19 | — | — | WO | disclosed |