Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | RAB9A | P51151 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 6/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | DPP4 | P27487 | 1/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8211777 | 1.00 | NPC1 (0.54) | NPC1MAPTRAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8216223 | 0.90 | NPC1 (0.50) | NPC1MAPTRAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8216220 | 0.90 | NPC1 (0.50) | NPC1MAPTRAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8216300 | 0.88 | NPC1 (0.48) | NPC1MAPTRAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8218357 | 0.88 | AKT1 (0.50) | NPC1MAPTRAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8216297 | 0.88 | NPC1 (0.48) | NPC1MAPTRAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8218353 | 0.88 | AKT1 (0.50) | NPC1MAPTRAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8219209 | 0.88 | NPC1 (0.60) | NPC1MAPTRAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8219212 | 0.88 | NPC1 (0.60) | NPC1MAPTRAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL8211286 | 0.86 | AKT1 (0.48) | NPC1MAPTRAB9AALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6046218-A | 4,5-DIMETHOXY-2-(3-OXO-3-PHENYL-1-PROPENYL)PYRIDINE USED TO CURE THE DISEASES PRODUCED BY CYTOKINE | SS PHARMACEUTICAL CO., LTD. (JP) | 2000-04-04 | — | — | US | disclosed |
| EP-0838457-A1 | NOVEL PYRIDINE DERIVATIVES AND MEDICINES CONTAINING THE SAME AS ACTIVE INGREDIENT | SS Pharmaceutical Co., Ltd. (JP) | 1998-04-29 | — | — | EP | disclosed |