Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1031789 | 0.90 | ROCK2 (0.52) | NAMPTROCK2ROCK1HPGDMAPT | |
| SCHEMBL1030186 | 0.77 | GAA (0.46) | ROCK2ROCK1HPGDTP53GAA | |
| SCHEMBL1030747 | 0.76 | NPC1 (0.53) | HPGDMAPTTP53SMN1; SMN2 | |
| SCHEMBL17150039 | 0.72 | CA12 (0.61) | NAMPTCA12CA1CA2CA14 | |
| SCHEMBL1081685 | 0.71 | NPSR1 (0.60) | L3MBTL1ALDH1A1TSHR | |
| SCHEMBL1028545 | 0.71 | ROCK2 (0.48) | NAMPTROCK2ROCK1HPGDMAPT | |
| SCHEMBL1009815 | 0.71 | MTNR1A (0.75) | CA12CA1CA2CA14MTNR1A | |
| SCHEMBL1032372 | 0.71 | TP53 (0.54) | HPGDMAPTTP53GAAL3MBTL1 | |
| SCHEMBL19055872 | 0.70 | CA12 (0.56) | NAMPTCA12CA1CA2CA14 | |
| SCHEMBL1029749 | 0.70 | NPC1 (0.47) | HPGDMAPTTP53GAAL3MBTL1 |
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-2035375-B1 | 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS | GRUENENTHAL GMBH (DE) | 2011-01-19 | — | — | EP | claimed |