Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.70 |
| ▸ | RAB9A | P51151 | 4/20 | 0.70 |
| ▸ | HTT | P42858 | 3/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.70 |
| ▸ | GAA | P10253 | 1/20 | 0.70 |
| ▸ | MEN1 | O00255 | 5/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL17165759 | 0.83 | NAPRT (0.52) | NPC1RAB9AHTTSMN1; SMN2GAA | |
| SCHEMBL11531994 | 0.83 | NAPRT (0.52) | NPC1RAB9AHTTSMN1; SMN2GAA | |
| SCHEMBL11531991 | 0.83 | NAPRT (0.52) | NPC1RAB9AHTTSMN1; SMN2GAA | |
| SCHEMBL2998577 | 0.82 | SMN1; SMN2 (1.00) | NPC1RAB9AHTTSMN1; SMN2GAA | |
| SCHEMBL10718651 | 0.81 | NPC1 (0.77) | NPC1RAB9AHTTSMN1; SMN2GAA | |
| SCHEMBL10717626 | 0.81 | NPC1 (0.77) | NPC1RAB9AHTTSMN1; SMN2GAA | |
| SCHEMBL10717636 | 0.81 | NPC1 (0.77) | NPC1RAB9AHTTSMN1; SMN2GAA | |
| SCHEMBL15893618 | 0.76 | NPC1 (0.63) | NPC1RAB9AHTTSMN1; SMN2GAA | |
| SCHEMBL4621713 | 0.74 | KMT2A (0.77) | NPC1RAB9ASMN1; SMN2GAAMEN1 | |
| SCHEMBL4121299 | 0.74 | NPC1 (0.67) | NPC1RAB9AHTTSMN1; SMN2GAA |
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-2017142883-A1 | TETRAHYDROQUINOLINE SUBSTITUTED HYDROXAMIC ACIDS AS SELECTIVE HISTONE DEACETYLASE 6 INHIBITORS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2017-08-24 | — | — | WO | disclosed |