Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.34 |
| ▸ | IDH1 | O75874 | 6/20 | 0.33 |
| ▸ | TACR1 | P25103 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL8714386 | 0.85 | LTB4R (0.31) | — | |
| SCHEMBL8717666 | 0.82 | HSD11B1 (0.32) | HSD11B1IDH1ADRA2AADRA2BADRA2C | |
| SCHEMBL8714354 | 0.78 | HRH3 (0.36) | KCNH2NPC1ALDH1A1RAB9AKMT2A | |
| SCHEMBL8719427 | 0.76 | UGT2B7 (0.38) | HSD11B1MCHR1KCNH2KMT2A | |
| SCHEMBL8717767 | 0.72 | ALOX5AP (0.37) | — | |
| SCHEMBL9244481 | 0.72 | REN (0.37) | HSD11B1ADRA2AADRA2BADRA2CKMT2A | |
| SCHEMBL8714391 | 0.72 | PDE10A (0.38) | MCHR1KMT2A | |
| SCHEMBL8714994 | 0.71 | SLC18A2 (0.36) | — | |
| SCHEMBL8713739 | 0.67 | OPRM1 (0.31) | — | |
| SCHEMBL9250623 | 0.63 | SLC6A3 (0.40) | HSD11B1MCHR1 |
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-5719291-A | FUNGICIDE | HOFFMANN-LA ROCHE INC. (US) | 1998-02-17 | — | — | US | disclosed |