Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12388321 | 0.83 | NPC1 (0.50) | NPC1RAB9AGAASMN1; SMN2HDAC1 | |
| SCHEMBL2019815 | 0.78 | ALDH1A1 (0.43) | NPC1RAB9AGAASMN1; SMN2HDAC1 | |
| SCHEMBL29988753 | 0.77 | HDAC6 (0.63) | NPC1RAB9AGAASMN1; SMN2HDAC1 | |
| SCHEMBL15199000 | 0.77 | HDAC6 (0.63) | NPC1RAB9AGAASMN1; SMN2HDAC1 | |
| SCHEMBL10021006 | 0.75 | TNF (0.52) | NPC1RAB9AGAASMN1; SMN2HDAC1 | |
| SCHEMBL2171116 | 0.74 | HDAC6 (0.48) | NPC1RAB9AGAASMN1; SMN2HDAC1 | |
| SCHEMBL2016350 | 0.74 | MAPT (0.50) | NPC1RAB9AGAASMN1; SMN2HDAC1 | |
| SCHEMBL15043387 | 0.74 | HDAC6 (0.41) | NPC1RAB9AGAASMN1; SMN2HDAC1 | |
| SCHEMBL12102425 | 0.74 | HDAC6 (0.66) | NPC1RAB9AGAASMN1; SMN2HDAC1 | |
| Hydrochloric Acid SCHEMBL2171109 | 0.73 | HDAC6 (0.47) | NPC1RAB9AGAASMN1; SMN2HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007966-A2 | PROCESS FOR PREPARATION OF INTERMEDIATES OF BENDAMUSTINE | BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) | 2012-01-19 | — | — | WO | disclosed |