Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 1/20 | 0.51 |
| ▸ | MMP9 | P14780 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | MME | P08473 | 2/20 | 0.43 |
| ▸ | ACE | P12821 | 2/20 | 0.43 |
| ▸ | TACR1 | P25103 | 1/20 | 0.43 |
| ▸ | ACP3 | P15309 | 1/20 | 0.42 |
| ▸ | CPA1 | P15085 | 1/20 | 0.42 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19230443 | 1.00 | CTNNB1 (0.51) | CTNNB1MMP9CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7297662 | 0.81 | CTNNB1 (0.46) | CTNNB1MMP9CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL16743938 | 0.79 | CTNNB1 (0.55) | CTNNB1MMP9TDP1L3MBTL1MME | |
| SCHEMBL6623784 | 0.79 | CTNNB1 (0.55) | CTNNB1MMP9TDP1L3MBTL1MME | |
| SCHEMBL13879137 | 0.79 | CTNNB1 (0.55) | CTNNB1MMP9TDP1L3MBTL1MME | |
| SCHEMBL14947768 | 0.79 | PPARG (0.41) | — | |
| SCHEMBL16261558 | 0.78 | CTNNB1 (0.54) | CTNNB1MMP9TDP1L3MBTL1TACR1 | |
| SCHEMBL16450886 | 0.78 | CTNNB1 (0.54) | CTNNB1MMP9TDP1L3MBTL1TACR1 | |
| SCHEMBL14950912 | 0.78 | ALDH1A1 (0.45) | — | |
| SCHEMBL15686536 | 0.78 | CTNNB1 (0.54) | CTNNB1MMP9TDP1L3MBTL1TACR1 |
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-2017136708-A1 | SYNTHESIS AND COMPOSITION OF RAPAFUCIN LIBRARIES | THE JOHNS HOPKINS UNIVERSITY (US) | 2017-08-10 | — | — | WO | disclosed |