Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.31 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.31 |
| ▸ | METAP2 | P50579 | 1/20 | 0.31 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.30 |
| ▸ | CSF1R | P07333 | 1/20 | 0.30 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8005862 | 0.97 | HTR2A (0.32) | HTR2AHTR2CSLC6A4HTR2BL3MBTL1 | |
| SCHEMBL8009623 | 0.89 | HTR2A (0.34) | HTR2AHTR2CSLC6A4HTR2BL3MBTL1 | |
| SCHEMBL8000552 | 0.82 | — | — | |
| SCHEMBL8010341 | 0.74 | TRPV1 (0.38) | L3MBTL1ALDH1A1RAB9ACHEK1NTRK1 | |
| SCHEMBL7999092 | 0.72 | ALDH1A1 (0.36) | HTR2AHTR2CSLC6A4HTR2BL3MBTL1 | |
| SCHEMBL8012587 | 0.71 | TRPV1 (0.40) | L3MBTL1ALDH1A1RAB9ACHEK1NTRK1 | |
| SCHEMBL7998586 | 0.70 | ALDH1A1 (0.35) | L3MBTL1ALDH1A1RAB9ACYP1A2SLC5A7 | |
| SCHEMBL8010265 | 0.68 | ALDH1A1 (0.37) | L3MBTL1ALDH1A1RAB9ACHEK1NTRK1 | |
| SCHEMBL8005747 | 0.66 | ALDH1A1 (0.37) | HTR2AHTR2CSLC6A4HTR2BL3MBTL1 | |
| SCHEMBL8008233 | 0.63 | ALDH1A1 (0.38) | L3MBTL1ALDH1A1RAB9A |
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-2009134987-A1 | DIFLUOROMETHYL-CONTAINING MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS | ENANTA PHARMACEUTICALS, INC. (US) | 2009-11-05 | — | — | WO | disclosed |