Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10594044 | 0.84 | NPC1 (0.49) | NPC1ALDH1A1GLAHTTRAB9A | |
| Hydrochloric Acid SCHEMBL17186270 | 0.80 | NPC1 (0.45) | NPC1ALDH1A1GLAHTTRAB9A | |
| SCHEMBL11842165 | 0.79 | ALDH1A1 (0.55) | ALDH1A1GLAHTTSMN1; SMN2HDAC1 | |
| SCHEMBL4827830 | 0.77 | ALOX5 (0.43) | NPC1ALDH1A1RAB9AHDAC1HDAC8 | |
| SCHEMBL7320181 | 0.76 | NPC1 (0.56) | NPC1ALDH1A1RAB9AHDAC1HDAC6 | |
| SCHEMBL1927016 | 0.74 | ALDH1A1 (0.69) | NPC1ALDH1A1GLAHTTRAB9A | |
| SCHEMBL1385745 | 0.73 | NPC1 (0.62) | NPC1ALDH1A1GLAHTTRAB9A | |
| SCHEMBL11835115 | 0.73 | LMNA (0.56) | NPC1ALDH1A1HDAC1HDAC8HDAC6 | |
| SCHEMBL9395118 | 0.72 | MET (0.39) | ALDH1A1PAX8SMN1; SMN2TRPM8GAA | |
| SCHEMBL2481899 | 0.71 | NPSR1 (0.46) | NPC1ALDH1A1HTTRAB9ATRPM8 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-5058986-A | — | — | None | — | — | JP | disclosed |
| JP-H0558986-A | SUBSTITUTED OXYBENZYLPHENYLGUANIDINE DERIVATIVE AND AGRICULTURAL AND HORTICULTURAL GERMICIDE | HOKKO CHEM IND CO LTD | 1993-03-09 | — | — | JP | disclosed |