Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | CASP3 | P42574 | 2/20 | 0.52 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.52 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.52 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.52 |
| ▸ | RELA | Q04206 | 1/20 | 0.52 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.52 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7947574 | 0.77 | ALDH1A1 (0.45) | ALDH1A1NPC1RAB9ACASP3SENP8 | |
| SCHEMBL6504227 | 0.74 | ALDH1A1 (0.44) | ALDH1A1NPC1RAB9ACASP3SENP8 | |
| SCHEMBL25485236 | 0.74 | ALDH1A1 (0.69) | ALDH1A1NPC1RAB9ACASP3SENP8 | |
| SCHEMBL102781 | 0.73 | MEN1 (0.37) | ALDH1A1NPC1RAB9AL3MBTL1PLA2G1B | |
| SCHEMBL6861337 | 0.68 | ALDH1A1 (0.60) | ALDH1A1NPC1RAB9ACASP3SENP8 | |
| SCHEMBL5680763 | 0.68 | ALDH1A1 (0.55) | ALDH1A1NPC1RAB9ACASP3SENP8 | |
| SCHEMBL36613 | 0.68 | NPC1 (1.00) | ALDH1A1NPC1RAB9ACASP3SENP8 | |
| SCHEMBL29402468 | 0.68 | NPC1 (1.00) | ALDH1A1NPC1RAB9ACASP3SENP8 | |
| SCHEMBL2951091 | 0.67 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1CYP1A2TDP1HPGD | |
| SCHEMBL1765602 | 0.67 | ALDH1A1 (0.57) | ALDH1A1NPC1RAB9ACASP3SENP8 |
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 |
|---|---|---|---|---|---|---|---|
| US-6114556-A | Metallocene compound and its use as catalyst component | TARGOR GMBH (DE) | 2000-09-05 | — | — | US | disclosed |
| US-5962359-A | Metallocene compound and its use as catalyst component | TARGOR GMBH (DE) | 1999-10-05 | — | — | US | disclosed |
| EP-0723971-A2 | Metallocenes and their use as catalyst component | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-07-31 | — | — | EP | disclosed |