Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.45 |
| ▸ | GAA | P10253 | 7/20 | 0.45 |
| ▸ | GFER | P55789 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 9/20 | 0.44 |
| ▸ | NPC1 | O15118 | 7/20 | 0.44 |
| ▸ | RAB9A | P51151 | 7/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.42 |
| ▸ | LMNA | P02545 | 6/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6971595 | 0.80 | MAPT (0.53) | ALDH1A1GAAGFERMAPTNPC1 | |
| SCHEMBL6981057 | 0.69 | ALDH1A1 (0.53) | ALDH1A1GAAGFERMAPTNPC1 | |
| SCHEMBL935875 | 0.68 | MEN1 (0.46) | ALDH1A1GAAGFERMAPTNPC1 | |
| SCHEMBL16273527 | 0.67 | ALDH1A1 (0.47) | ALDH1A1GAAGFERMAPTNPC1 | |
| SCHEMBL17126917 | 0.67 | ALDH1A1 (0.50) | ALDH1A1GAAGFERMAPTNPC1 | |
| SCHEMBL922745 | 0.65 | MAPT (0.53) | ALDH1A1GAAGFERMAPTNPC1 | |
| SCHEMBL22149618 | 0.65 | NPC1 (0.47) | ALDH1A1GAAGFERMAPTNPC1 | |
| SCHEMBL10522288 | 0.63 | NPC1 (0.45) | ALDH1A1GAAGFERMAPTNPC1 | |
| SCHEMBL27484780 | 0.63 | MEN1 (0.41) | ALDH1A1GAAGFERMAPTNPC1 | |
| SCHEMBL23960849 | 0.61 | ALDH1A1 (0.59) | ALDH1A1GAAGFERMAPTNPC1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6214813-B1 | AZOPYRAZOLES | KINETEK PHARMACEUTICALS, INC. (CA) | 2001-04-10 | — | — | US | claimed |
| EP-1276723-A2 | PYRAZOLE COMPOUNDS HAVING ANTI PROLIFERATIVE ACTIVITY | Kinetek Pharmaceuticals, Inc. (CA) | 2003-01-22 | — | — | EP | disclosed |
| US-6436915-B1 | ANTIPROLIFERATIVE AND ANTITUMOR AGENTS AND ANGIOGENESIS INHIBITORS | KINETEK PHARMACEUTICALS, INC. (CA) | 2002-08-20 | — | — | US | disclosed |
| US-20020042501-A1 | Pyrazole compounds | DERMIRA (CANADA), INC. | 2002-04-11 | — | — | US | disclosed |
| WO-2001077080-A2 | PYRAZOLE COMPOUNDS HAVING ANTI PROLIFERATIVE ACTIVITY | KINETEK PHARMACEUTICALS, INC. (CA) | 2001-10-18 | — | — | WO | disclosed |
| US-6214813-B1 | AZOPYRAZOLES | KINETEK PHARMACEUTICALS, INC. (CA) | 2001-04-10 | — | — | US | disclosed |