Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | ASIC3 | Q9UHC3 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | METAP2 | P50579 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.41 |
| ▸ | AXL | P30530 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1018949 | 0.84 | ASIC3 (0.55) | HTR1AHTR7NPC1RAB9AALDH1A1 | |
| SCHEMBL29851729 | 0.84 | ASIC3 (0.55) | HTR1AHTR7NPC1RAB9AALDH1A1 | |
| Imidazole SCHEMBL27841951 | 0.84 | CYP2A6 (0.41) | HRH3NPC1RAB9AALDH1A1MEN1 | |
| Imidazole SCHEMBL28227084 | 0.83 | CYP2A6 (0.50) | HRH3NPC1RAB9AALDH1A1KDM4E | |
| Dipyridyl SCHEMBL28370248 | 0.79 | KDM4E (0.58) | NPC1RAB9AALDH1A1KDM4ELMNA | |
| Dipyridyl SCHEMBL7143241 | 0.79 | KDM4E (0.58) | NPC1RAB9AALDH1A1KDM4ELMNA | |
| Imidazole SCHEMBL28133821 | 0.79 | CYP3A4 (0.50) | ALDH1A1MEN1KDM4ELMNAMAPT | |
| Dipyridyl SCHEMBL3491432 | 0.78 | KDM4E (0.56) | NPC1RAB9AALDH1A1KDM4ELMNA | |
| Dipyridyl SCHEMBL3847534 | 0.78 | KDM4E (0.56) | NPC1RAB9AALDH1A1KDM4ELMNA | |
| Dipyridyl SCHEMBL5456778 | 0.75 | KDM4E (0.52) | NPC1RAB9AALDH1A1KDM4ELMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102180838-A | Aromatic diamine containing imidazolyl and preparation method thereof | UNIV SHANGHAI JIAOTONG | 2011-09-14 | — | — | CN | claimed |
| CN-102180838-A | Aromatic diamine containing imidazolyl and preparation method thereof | UNIV SHANGHAI JIAOTONG | 2011-09-14 | — | — | CN | disclosed |