Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | CPT1A | P50416 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | PPIA | P62937 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1721150 | 0.87 | ALDH1A1 (0.47) | ALDH1A1LMNAKMT2ANPC1RAB9A | |
| SCHEMBL1721164 | 0.86 | NPC1 (0.49) | ALDH1A1LMNAKMT2ANPC1RAB9A | |
| SCHEMBL2751546 | 0.86 | ALDH1A1 (0.62) | ALDH1A1LMNAKMT2ANPC1RAB9A | |
| SCHEMBL17074462 | 0.86 | ALDH1A1 (0.50) | ALDH1A1LMNAKMT2ANPC1RAB9A | |
| SCHEMBL1722762 | 0.85 | ALDH1A1 (0.46) | ALDH1A1LMNAKMT2ANPC1RAB9A | |
| SCHEMBL1721307 | 0.84 | ALDH1A1 (0.42) | ALDH1A1LMNAKMT2ANPC1RAB9A | |
| SCHEMBL1722136 | 0.81 | ALDH1A1 (0.45) | ALDH1A1LMNAKMT2ANPC1RAB9A | |
| SCHEMBL1721469 | 0.79 | NPC1 (0.53) | ALDH1A1LMNAKMT2ANPC1RAB9A | |
| SCHEMBL1722196 | 0.78 | ALDH1A1 (0.49) | ALDH1A1LMNAKMT2ANPC1RAB9A | |
| SCHEMBL2751209 | 0.77 | KMT2A (0.59) | ALDH1A1LMNAKMT2ANPC1RAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2406226-B1 | SUBSTITUTED NICOTINAMIDES AS KCNQ2/3 MODULATORS | GRUENENTHAL GMBH (DE) | 2015-09-16 | — | — | EP | claimed |
| EP-2406226-A1 | SUBSTITUTED NICOTINAMIDES AS KCNQ2/3 MODULATORS | Grünenthal GmbH (DE) | 2012-01-18 | — | — | EP | claimed |
| WO-2010102809-A1 | SUBSTITUTED NICOTINAMIDES AS KCNQ2/3 MODULATORS | Grünenthal GmbH (DE) | 2010-09-16 | — | — | WO | claimed |
| EP-2406226-B1 | SUBSTITUTED NICOTINAMIDES AS KCNQ2/3 MODULATORS | GRUENENTHAL GMBH (DE) | 2015-09-16 | — | — | EP | disclosed |