Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | ACACB | O00763 | 4/20 | 0.44 |
| ▸ | ACACA | Q13085 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.42 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 4/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 4/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4216870 | 0.77 | HPGD (0.54) | HTTALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL4015528 | 0.76 | MAPT (0.47) | NPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL18181863 | 0.75 | ALDH1A1 (0.47) | HTTALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL14384849 | 0.74 | RAF1 (0.56) | HTTALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL4008794 | 0.72 | NPC1 (0.48) | ALDH1A1HPGDNPC1RAB9AKMT2A | |
| SCHEMBL9853804 | 0.71 | PTGS1 (0.62) | ALDH1A1RAB9AMAPTPOLB | |
| SCHEMBL14015136 | 0.71 | LOXL2 (0.45) | HTTALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL16792742 | 0.71 | LOXL2 (0.42) | HTTALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL28294431 | 0.71 | ALDH1A1 (0.59) | ALDH1A1HPGDNPC1RAB9AGAA | |
| SCHEMBL11814009 | 0.70 | PTGS1 (0.49) | ALDH1A1HPGDNPC1RAB9AACACB |
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 |
|---|---|---|---|---|---|---|---|
| US-7452880-B2 | Substituted pyrazolo [3,4-d] pyrimidines and methods of using the same | F. HOFFMANN-LA ROCHE AG (CH) | 2008-11-18 | — | — | US | disclosed |