Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 3/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MYC | P01106 | 1/20 | 0.33 |
| ▸ | CD44 | P16070 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | NSD2 | O96028 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30485469 | 1.00 | HKDC1 (0.36) | HKDC1ALDH1A1RAPGEF4MAOAMAOB | |
| SCHEMBL16219593 | 0.86 | RAPGEF4 (0.40) | ALDH1A1RAPGEF4CRHR1PDK2MAPK1 | |
| SCHEMBL28600277 | 0.80 | ALDH1A1 (0.46) | ALDH1A1RAPGEF4MAOAMAOBCRHR1 | |
| SCHEMBL27404519 | 0.78 | RAPGEF4 (0.40) | ALDH1A1RAPGEF4CRHR1PDK2MAPK1 | |
| SCHEMBL17265202 | 0.78 | RAPGEF4 (0.39) | ALDH1A1RAPGEF4MAOAMAOBCRHR1 | |
| SCHEMBL31206514 | 0.74 | MAP4K4 (0.46) | ALDH1A1MAOBMAPK1SMN1; SMN2MEN1 | |
| SCHEMBL17907367 | 0.74 | CD44 (0.47) | HKDC1ALDH1A1MAPK1CYP1A1CYP1A2 | |
| SCHEMBL27876481 | 0.74 | HKDC1 (0.37) | HKDC1ALDH1A1PDK2MAPK1L3MBTL1 | |
| SCHEMBL5826733 | 0.73 | CYP3A4 (0.50) | ALDH1A1RAPGEF4CRHR1PDK2MYC | |
| SCHEMBL6637111 | 0.72 | ALDH1A1 (0.50) | ALDH1A1MAOBPDK2CYP1A2MYC |
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-114127132-B | Olefin polymerization catalyst with thiazole or imidazole | 陶氏环球技术有限责任公司 | 2023-06-20 | — | — | CN | disclosed |
| WO-2020263790-A1 | OLEFIN POLYMERIZATION CATALYSTS BEARING A THIAZOLE OR IMIDAZOLE | DOW GLOBAL TECHNOLOGIES LLC (US) | 2020-12-30 | — | — | WO | disclosed |