Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4036425 | 0.86 | PLAU (0.44) | ALDH1A1LMNAHTTPKMHSD17B10 | |
| SCHEMBL666127 | 0.78 | PLAU (0.40) | MAPTALDH1A1LMNAHTTCYP3A4 | |
| SCHEMBL14200032 | 0.77 | GRM5 (0.46) | MAPTLMNAMEN1KMT2ATRPV1 | |
| SCHEMBL3954421 | 0.77 | DPP8 (0.39) | ALDH1A1LMNAHTTCYP3A4HSD17B10 | |
| SCHEMBL4162406 | 0.77 | TRPM8 (0.37) | ALDH1A1LMNAHTTHSD17B10GAA | |
| SCHEMBL353286 | 0.75 | MAPT (0.48) | MAPTALDH1A1LMNAHTTPKM | |
| SCHEMBL2700570 | 0.73 | TRPM8 (0.43) | MAPK1 | |
| SCHEMBL3951150 | 0.72 | IDO1 (0.40) | ALDH1A1LMNAHSD17B10KDM4EHPGD | |
| SCHEMBL5327477 | 0.72 | MMP9 (0.62) | LMNAHTTGAAMMP9MMP8 | |
| SCHEMBL5656046 | 0.71 | GAA (0.42) | MAPTALDH1A1LMNAHTTPKM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2010493-A2 | PYRIDYL AMIDE T-TYPE CALCIUM CHANNEL ANTAGONISTS | Merck & Co., Inc. (US) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007120729-A2 | PYRIDYL AMIDE T-TYPE CALCIUM CHANNEL ANTAGONISTS | MERCK & CO., INC. (US) | 2007-10-25 | — | — | WO | disclosed |