Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SETDB1 | Q15047 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.35 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 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 | |
|---|---|---|---|---|
| SCHEMBL286231 | 0.84 | CYP2A6 (0.43) | CYP2A6ALDH1A1MAPTSETDB1MAP2K1 | |
| SCHEMBL394617 | 0.79 | XDH (0.46) | CYP2A6SETDB1KDM4CMAP2K1 | |
| SCHEMBL8995796 | 0.78 | LMNA (0.40) | ALDH1A1RAB9AHSD17B1 | |
| SCHEMBL1169569 | 0.78 | CYP2A6 (0.41) | CYP2A6ALDH1A1MAPTSETDB1HSD17B1 | |
| SCHEMBL29740345 | 0.78 | CYP2A6 (0.41) | CYP2A6ALDH1A1MAPTSETDB1HSD17B1 | |
| SCHEMBL2435113 | 0.76 | CYP2A6 (0.40) | CYP2A6SETDB1HSD17B1KDM4CMAP2K1 | |
| SCHEMBL5567273 | 0.76 | FLT1 (0.48) | ALDH1A1MAPTHSD17B1TDP1L3MBTL1 | |
| SCHEMBL3089078 | 0.75 | ALDH1A1 (0.47) | ALDH1A1RAB9A | |
| SCHEMBL13563786 | 0.75 | KDM4E (0.47) | ALDH1A1MAPTL3MBTL1TP53 | |
| SCHEMBL10589976 | 0.75 | KDM4C (0.37) | CYP2A6SETDB1RAB9AKDM4CMAP2K1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0849263-A2 | Pharmaceutical substituted propanoic acid derivatives | ELI LILLY AND COMPANY LIMITED (GB) | 1998-06-24 | — | — | EP | disclosed |