Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | HTT | P42858 | 3/20 | 0.53 |
| ▸ | CASP1 | P29466 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | CASP7 | P55210 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.53 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.46 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8502561 | 0.85 | ALDH1A1 (0.58) | ALDH1A1HTTCASP1MEN1KMT2A | |
| SCHEMBL691201 | 0.76 | ALDH1A1 (0.49) | ALDH1A1HTTCASP1MEN1CASP7 | |
| SCHEMBL150476 | 0.76 | NPC1 (0.65) | ALDH1A1HTTCASP1MEN1CASP7 | |
| SCHEMBL29350099 | 0.76 | NPC1 (0.65) | ALDH1A1HTTCASP1MEN1CASP7 | |
| SCHEMBL30489850 | 0.74 | ALDH1A1 (1.00) | ALDH1A1HTTCASP1MEN1CASP7 | |
| SCHEMBL29518639 | 0.74 | ALDH1A1 (1.00) | ALDH1A1HTTCASP1MEN1CASP7 | |
| SCHEMBL12361 | 0.74 | ALDH1A1 (1.00) | ALDH1A1HTTCASP1MEN1CASP7 | |
| SCHEMBL270025 | 0.73 | TERT (0.59) | ALDH1A1HTTCASP1MEN1CASP7 | |
| SCHEMBL3726615 | 0.73 | NPC1 (0.68) | ALDH1A1HTTCASP1MEN1CASP7 | |
| SCHEMBL29485612 | 0.73 | NPC1 (0.68) | ALDH1A1HTTCASP1MEN1CASP7 |
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-5372813-A | Measurement of serotonin uptake sites in a sample using a radio labeled substituted 6-nitroquipazine as a radioligand | THE REGENTS, UNIVERSITY OF CALIFORNIA (US) | 1994-12-13 | — | — | US | disclosed |