Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | LMNA | P02545 | 5/20 | 0.55 |
| ▸ | MAPT | P10636 | 7/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.39 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14207434 | 0.83 | ALDH1A1 (0.51) | ALDH1A1LMNAMAPTKMT2ATDP1 | |
| SCHEMBL30879181 | 0.81 | ALDH1A1 (0.55) | ALDH1A1LMNAMAPTHTTKMT2A | |
| SCHEMBL2561960 | 0.80 | ALDH1A1 (0.59) | ALDH1A1LMNAMAPTHTTKMT2A | |
| SCHEMBL7061229 | 0.78 | MAPT (0.63) | ALDH1A1LMNAMAPTHTTKMT2A | |
| SCHEMBL14206762 | 0.76 | LMNA (0.53) | ALDH1A1LMNAMAPTKMT2ATDP1 | |
| SCHEMBL14206405 | 0.76 | LMNA (0.53) | ALDH1A1LMNAMAPTKMT2ATDP1 | |
| SCHEMBL3436184 | 0.76 | LMNA (0.64) | ALDH1A1LMNAMAPTHTTKMT2A | |
| SCHEMBL9983995 | 0.76 | ALDH1A1 (0.57) | ALDH1A1LMNAMAPTHTTKMT2A | |
| SCHEMBL14206379 | 0.76 | ALDH1A1 (0.52) | ALDH1A1LMNAMAPTKMT2ATDP1 | |
| SCHEMBL30921278 | 0.73 | KMT2A (0.55) | ALDH1A1LMNAMAPTHTTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2078003-B1 | ANILINOPIPERAZINE DERIVATIVES AND METHODS OF USE THEREOF | MERCK SHARP & DOHME (US) | 2017-03-08 | — | — | EP | disclosed |