Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | KAT6A | Q92794 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.38 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.37 |
| ▸ | REN | P00797 | 6/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL11299074 | 0.93 | PPARG (0.41) | PPARGKAT6ACYP2D6CYP4F2CYP4A11 | |
| SCHEMBL11294344 | 0.86 | CYP4F2 (0.43) | PPARGCYP2D6CYP4F2CYP4A11KCNH2 | |
| SCHEMBL11299265 | 0.84 | ABCB1 (0.38) | PSMB5REN | |
| SCHEMBL11299184 | 0.82 | HDAC8 (0.42) | PPARG | |
| SCHEMBL11298083 | 0.81 | CYP4F2 (0.40) | PPARGCYP2D6CYP4F2CYP4A11 | |
| SCHEMBL11300765 | 0.80 | PPARG (0.40) | PPARGCYP4F2CYP4A11 | |
| SCHEMBL11296832 | 0.78 | SLC7A5 (0.44) | PPARGKAT6ACYP4F2CYP4A11 | |
| SCHEMBL11296572 | 0.78 | PSMB5 (0.35) | PSMB5 | |
| SCHEMBL11297857 | 0.77 | REN (0.39) | KAT6ARENHTR1AADRA1DHTR2A | |
| SCHEMBL11298187 | 0.77 | TAS1R3 (0.40) | — |
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-4261732-A | Alkyl and alkoxyalkyl N-3-alkyl and N-3,5-dialkylbenzoyl-N-isopropylaminoacetate herbicides | PPG INDUSTRIES, INC. (US) | 1981-04-14 | — | — | US | disclosed |