Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | CTSB | P07858 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CCR1 | P32246 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7300117 | 0.87 | HDAC2 (0.51) | SMN1; SMN2CTSBCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL13054604 | 0.86 | SMN1; SMN2 (0.50) | SMN1; SMN2CTSBCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL13054596 | 0.86 | SMN1; SMN2 (0.50) | SMN1; SMN2CTSBCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL19791859 | 0.81 | HDAC2 (0.54) | SMN1; SMN2CTSBCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8089676 | 0.80 | SMN1; SMN2 (0.57) | SMN1; SMN2CYP2C9TSHRCYP2C19CNR2 | |
| SCHEMBL8085372 | 0.80 | SMN1; SMN2 (0.57) | SMN1; SMN2CYP2C9TSHRCYP2C19CNR2 | |
| SCHEMBL18822410 | 0.79 | CCR1 (0.57) | SMN1; SMN2CYP1A2CYP3A4CYP2C9TSHR | |
| SCHEMBL7772333 | 0.77 | ALDH1A1 (0.66) | SMN1; SMN2CNR2HDAC3HDAC2HDAC8 | |
| SCHEMBL7307323 | 0.77 | CTSL (0.58) | CTSBCYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL9637183 | 0.76 | CTSC (0.51) | CYP1A2CYP3A4CYP2D6 |
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-2013100132-A1 | PEPTIDE-COMPOUND CYCLIZATION METHOD | 中外製薬株式会社 (JP) | 2013-07-04 | — | — | WO | disclosed |