Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.57 |
| ▸ | HTR3B | O95264 | 1/20 | 0.57 |
| ▸ | HTR1D | P28221 | 1/20 | 0.57 |
| ▸ | HTR2C | P28335 | 1/20 | 0.57 |
| ▸ | HTR3A | P46098 | 1/20 | 0.57 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.57 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 5/20 | 0.53 |
| ▸ | TSHR | P16473 | 4/20 | 0.53 |
| ▸ | HTT | P42858 | 3/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2185882 | 0.94 | LMNA (0.60) | ALDH1A1MAPTLMNATSHRHTT | |
| SCHEMBL2187066 | 0.91 | LMNA (0.58) | ALDH1A1MAPTLMNATSHRHTT | |
| SCHEMBL27756397 | 0.90 | LMNA (0.55) | ALDH1A1MAPTLMNATSHRHTT | |
| SCHEMBL2188169 | 0.90 | LMNA (0.55) | ALDH1A1MAPTLMNATSHRHTT | |
| SCHEMBL2185460 | 0.88 | KMT2A (0.57) | ALDH1A1MAPTLMNATSHRHTT | |
| SCHEMBL2187968 | 0.88 | KMT2A (0.57) | ALDH1A1MAPTLMNATSHRHTT | |
| SCHEMBL2187496 | 0.86 | ATM (0.53) | ALDH1A1MAPTLMNATSHRHTT | |
| SCHEMBL2211193 | 0.85 | KMT2A (0.52) | ALDH1A1MAPTLMNATSHRHTT | |
| SCHEMBL2188167 | 0.85 | KCNA5 (0.52) | ALDH1A1MAPTLMNATSHRHTT | |
| SCHEMBL2187117 | 0.85 | ATM (0.52) | ALDH1A1MAPTTHRBLMNATSHR |
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-2343293-A1 | NOVEL PIPERIDIN-4-YL-THIAZOLE-CARBOXAMIDE ANALOGUES AS INHIBITORS OF T-CELL PROLIFERATION AND USES THEREOF | 4SC AG (DE) | 2011-07-13 | — | — | EP | disclosed |