Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | ALPG | P10696 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 6/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6535530 | 0.80 | ALDH1A1 (0.43) | SMN1; SMN2LMNAALDH1A1ALPGHPGD | |
| SCHEMBL18264194 | 0.80 | PBRM1 (0.52) | ALDH1A1NPSR1FFAR1 | |
| SCHEMBL2139054 | 0.75 | PDPK1 (0.62) | KMT2A | |
| SCHEMBL4919512 | 0.74 | SMN1; SMN2 (0.40) | SMN1; SMN2LMNAALDH1A1ALPGHPGD | |
| SCHEMBL28732491 | 0.72 | ALDH1A1 (0.44) | LMNAALDH1A1CYP2C19KMT2A | |
| SCHEMBL2142907 | 0.72 | PDPK1 (0.63) | SMN1; SMN2LMNAALDH1A1ALPGHPGD | |
| SCHEMBL7247130 | 0.71 | SMN1; SMN2 (0.47) | SMN1; SMN2LMNAALDH1A1ALPGHPGD | |
| SCHEMBL23237367 | 0.71 | AOC3 (0.47) | SMN1; SMN2LMNAALDH1A1ALPGHPGD | |
| SCHEMBL7933326 | 0.71 | AOC3 (0.47) | SMN1; SMN2LMNAALDH1A1ALPGHPGD | |
| SCHEMBL11084525 | 0.70 | ESR1 (0.48) | SMN1; SMN2LMNAALDH1A1ALPGHPGD |
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-2002076940-A2 | PROCESS FOR PREPARING ARYLPIPERIDINE CARBINOL INTERMEDIATES AND DERIVATIVES | PENTECH PHARMACEUTICALS, INC. (US) | 2002-10-03 | — | — | WO | claimed |