Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | APAF1 | O14727 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.37 |
| ▸ | TSPO | P30536 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7985647 | 0.78 | ALDH1A1 (0.50) | ALDH1A1TSHRMEN1KMT2ANPC1 | |
| SCHEMBL7969124 | 0.78 | ALDH1A1 (0.44) | ALDH1A1TSHRMEN1KMT2ANPC1 | |
| SCHEMBL24654512 | 0.74 | ALDH1A1 (0.49) | ALDH1A1TSHRMEN1KMT2ANPC1 | |
| SCHEMBL741752 | 0.72 | NPSR1 (0.64) | ALDH1A1TSHRMEN1KMT2ANPC1 | |
| SCHEMBL5603988 | 0.72 | TSPO (0.56) | ALDH1A1TSHRMEN1KMT2ANPC1 | |
| SCHEMBL7978954 | 0.71 | ALDH1A1 (0.43) | ALDH1A1TSHRMEN1KMT2ANPC1 | |
| SCHEMBL7982464 | 0.71 | MEN1 (0.47) | ALDH1A1TSHRMEN1KMT2ANPC1 | |
| SCHEMBL8044893 | 0.70 | NPSR1 (0.61) | ALDH1A1TSHRMEN1KMT2ANPC1 | |
| Hydrochloric Acid SCHEMBL8550497 | 0.70 | NPSR1 (0.61) | ALDH1A1TSHRMEN1KMT2ANPC1 | |
| SCHEMBL8693257 | 0.69 | AGTR1 (0.45) | ALDH1A1TSHRMEN1KMT2ANPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6235730-B1 | ANTICHOLESTEROL AGENT, ANTILIPEMIC AGENT | JAPAN TOBACCO, INC. (JP) | 2001-05-22 | — | — | US | disclosed |
| CN-1252068-A | 3-piperidyl-4-oxoquinazoline derivatives and pharmaceutical compositions containing the same | JAPAN TOBACCO INC (JP) | 2000-05-03 | — | — | CN | disclosed |
| EP-0970954-A1 | 3-PIPERIDYL-4-OXOQUINAZOLINE DERIVATIVES AND MEDICINCAL COMPOSITIONS CONTAINING THE SAME | JAPAN TOBACCO INC. (JP) | 2000-01-12 | — | — | EP | disclosed |