Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 5/20 | 0.35 |
| ▸ | HTR2C | P28335 | 5/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 5/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CEL | P19835 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9247410 | 1.00 | RIPK1 (0.36) | RIPK1HTR2AHTR2CP2RX7CYP2C9 | |
| SCHEMBL9247386 | 0.95 | HTR2A (0.36) | RIPK1HTR2AHTR2CP2RX7CYP2C9 | |
| SCHEMBL9247392 | 0.95 | HTR2A (0.36) | RIPK1HTR2AHTR2CP2RX7CYP2C9 | |
| SCHEMBL10709502 | 0.93 | CYP2C9 (0.38) | HTR2AHTR2CCYP2C9MAOBMAOA | |
| SCHEMBL10709504 | 0.93 | CYP2C9 (0.38) | HTR2AHTR2CCYP2C9MAOBMAOA | |
| SCHEMBL9249614 | 0.90 | CYP1A2 (0.39) | RIPK1HTR2AHTR2CP2RX7CYP2C9 | |
| SCHEMBL9249619 | 0.90 | CYP1A2 (0.39) | RIPK1HTR2AHTR2CP2RX7CYP2C9 | |
| SCHEMBL9251450 | 0.90 | RIPK1 (0.36) | RIPK1HTR2AHTR2CP2RX7MAOB | |
| SCHEMBL9251454 | 0.90 | RIPK1 (0.36) | RIPK1HTR2AHTR2CP2RX7MAOB | |
| SCHEMBL13136427 | 0.90 | CYP2C9 (0.36) | HTR2AHTR2CCYP2C9MAOBMAOA |
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-1995010496-A1 | 2,3,4-TRIFLUOROBENZENES AND THEIR USE IN LIQUID CRYSTAL MIXTURES | MERCK PATENT GMBH (DE) | 1995-04-20 | — | — | WO | disclosed |