Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HNF4A | P41235 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 7/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | SLC9A1 | P19634 | 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 | |
|---|---|---|---|---|
| SCHEMBL7680902 | 0.79 | BCAT2 (0.40) | BCAT2NPC1RAB9APARP1KEAP1 | |
| SCHEMBL5335642 | 0.73 | CHEK2 (0.40) | BCAT2DHODH | |
| SCHEMBL7676028 | 0.71 | PIM1 (0.37) | BCAT2IKBKBMEN1KMT2A | |
| SCHEMBL13739918 | 0.69 | CYP3A4 (0.54) | BCAT2NPC1RAB9AHNF4APARP1 | |
| SCHEMBL16149659 | 0.69 | BCAT2 (0.91) | BCAT2NPC1RAB9AHNF4APARP1 | |
| SCHEMBL29427545 | 0.69 | BCAT2 (1.00) | BCAT2NPC1RAB9AHNF4APARP1 | |
| SCHEMBL132986 | 0.69 | BCAT2 (1.00) | BCAT2NPC1RAB9AHNF4APARP1 | |
| SCHEMBL2487391 | 0.68 | ALDH1A1 (0.47) | TSHRMEN1KMT2ASMN1; SMN2 | |
| Urea SCHEMBL28572437 | 0.68 | BCAT2 (0.96) | BCAT2NPC1RAB9AHNF4APARP1 | |
| Hydrochloric Acid SCHEMBL1785690 | 0.68 | BCAT2 (0.96) | BCAT2NPC1RAB9AHNF4APARP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6369088-B2 | ANTIDIABETIC AGENTS | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2002-04-09 | — | — | US | disclosed |