Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | TACR2 | P21452 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SHBG | P04278 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL230397 | 1.00 | KCNH2 (0.47) | KCNH2CYP19A1HRH4HRH3ALDH1A1 | |
| Bromide SCHEMBL5723264 | 0.98 | KCNH2 (0.46) | KCNH2CYP19A1HRH4HRH3ALDH1A1 | |
| SCHEMBL10830973 | 0.98 | KCNH2 (0.44) | KCNH2CYP19A1HRH4HRH3ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL17372911 | 0.96 | KCNH2 (0.42) | KCNH2CYP19A1HRH4HRH3ALDH1A1 | |
| SCHEMBL11116422 | 0.92 | KCNH2 (0.36) | KCNH2HRH3ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL2708608 | 0.74 | KCNH2 (0.50) | KCNH2CYP19A1ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL29737342 | 0.74 | KCNH2 (0.50) | KCNH2CYP19A1ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL29886625 | 0.74 | KCNH2 (0.50) | KCNH2CYP19A1ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL28254740 | 0.74 | KCNH2 (0.50) | KCNH2CYP19A1ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL28091636 | 0.74 | KCNH2 (0.50) | KCNH2CYP19A1ALDH1A1TDP1L3MBTL1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1077922-B1 | POLYAMINE | KAO CORP (JP) | 2004-02-18 | — | — | EP | disclosed |
| US-6667382-B1 | Straight chain aliphatic amine salt with primary, secondary and tertiary functionality; workability; emulsifying quick setting asphalt | KAO CORPORATION (JP) | 2003-12-23 | — | — | US | disclosed |
| EP-1077922-A1 | POLYAMINE | Kao Corporation (JP) | 2001-02-28 | — | — | EP | disclosed |
| JP-2000034259-A | POLYAMINE | KAO CORP | 2000-02-02 | — | — | JP | disclosed |
| WO-1999058491-A1 | POLYAMINE | KAO CORPORATION (JP) | 1999-11-18 | — | — | WO | disclosed |