Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL18015301 | 0.96 | NPC1 (0.44) | KIF11TGFBR1NPC1RAB9AALDH1A1 | |
| SCHEMBL19794405 | 0.89 | NPC1 (0.40) | KIF11TGFBR1NPC1RAB9AALDH1A1 | |
| SCHEMBL21020818 | 0.86 | ASIC3 (0.39) | KIF11TGFBR1NPC1RAB9AALDH1A1 | |
| SCHEMBL29904515 | 0.85 | KIF11 (0.50) | KIF11TGFBR1NPC1RAB9AALDH1A1 | |
| SCHEMBL361274 | 0.85 | KIF11 (0.50) | KIF11TGFBR1NPC1RAB9AALDH1A1 | |
| SCHEMBL31695223 | 0.85 | KIF11 (0.43) | KIF11TGFBR1NPC1RAB9AALDH1A1 | |
| SCHEMBL27344642 | 0.85 | KIF11 (0.43) | KIF11TGFBR1NPC1RAB9AALDH1A1 | |
| SCHEMBL19933667 | 0.84 | FAAH (0.39) | KIF11NPC1RAB9AALDH1A1PLA2G1B | |
| SCHEMBL18015705 | 0.84 | RPS6KA3 (0.42) | KIF11DGAT1 | |
| SCHEMBL19794448 | 0.84 | TRPV1 (0.46) | TGFBR1NPC1RAB9AALDH1A1TRPV1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021013775-A1 | METHOD FOR PRODUCING ORTHO-METALLATED METAL COMPOUNDS | MERCK PATENT GMBH (DE) | 2021-01-28 | — | — | WO | disclosed |