Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 6/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3264283 | 0.80 | ALDH1A1 (0.50) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL3262867 | 0.79 | ALKBH5 (0.54) | NPC1RAB9AMEN1KMT2AALKBH5 | |
| SCHEMBL1114873 | 0.73 | HSP90AA1 (0.46) | NPC1RAB9AKMT2AALDH1A1GAA | |
| SCHEMBL3835955 | 0.70 | ALDH1A1 (0.39) | NPC1RAB9AHSD17B10MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL5460959 | 0.69 | HSD17B10 (0.50) | NPC1RAB9AESR1HSD17B10MEN1 | |
| SCHEMBL9000975 | 0.69 | TSHR (0.67) | NPC1RAB9AHSD17B10MEN1KMT2A | |
| SCHEMBL14402131 | 0.69 | ALDH1A1 (0.59) | NPC1RAB9AHSD17B10MEN1KMT2A | |
| SCHEMBL29665057 | 0.69 | ALDH1A1 (0.59) | NPC1RAB9AHSD17B10MEN1KMT2A | |
| SCHEMBL16516470 | 0.67 | ACHE (0.47) | NPC1RAB9AHSD17B10MEN1KMT2A | |
| SCHEMBL10059729 | 0.67 | ALDH1A1 (0.64) | NPC1RAB9AESR1HSD17B10MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010015657-A2 | NEW ALKOXYPYRAZOLES | INSTITUT PASTEUR (FR) | 2010-02-11 | — | — | WO | disclosed |
| WO-2010015657-A2 | NEW ALKOXYPYRAZOLES | INSTITUT PASTEUR (FR) | 2010-02-11 | — | — | WO | disclosed |
| EP-2151433-A1 | Alkoxypyrazoles and the process for their preparation | Institut Pasteur (FR) | 2010-02-10 | — | — | EP | disclosed |
| EP-2151433-A1 | Alkoxypyrazoles and the process for their preparation | Institut Pasteur (FR) | 2010-02-10 | — | — | EP | disclosed |