Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11605005 | 0.82 | NPC1 (0.38) | HTTMEN1KMT2APOLBNPC1 | |
| SCHEMBL11608397 | 0.80 | KMT2A (0.46) | HTTMEN1KMT2APOLBKDM4E | |
| SCHEMBL11604789 | 0.75 | PDE10A (0.35) | HTTMEN1KMT2ASLC6A2NPC1 | |
| SCHEMBL21917609 | 0.70 | L3MBTL1 (0.42) | HTTPOLBSLC6A2NPC1KDM4E | |
| SCHEMBL20551427 | 0.67 | KDM5A (0.44) | HTTSLC6A2NPC1KDM4EL3MBTL1 | |
| SCHEMBL238508 | 0.67 | MAPT (0.45) | HTTMEN1KMT2ANPC1KDM4E | |
| SCHEMBL16695720 | 0.67 | PARP1 (0.63) | MEN1KMT2ANPC1KDM4EALDH1A1 | |
| SCHEMBL20561458 | 0.66 | PDE10A (0.36) | HTTPOLBSLC6A2NPC1KDM4E | |
| SCHEMBL21917537 | 0.66 | KDM4E (0.41) | HTTMEN1KMT2APOLBSLC6A2 | |
| SCHEMBL2964886 | 0.66 | NPC1 (0.47) | HTTMEN1KMT2APOLBNPC1 |
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-4072680-A | Derivatives of pyrazolo[1,5-a]pyrido[3,2-e]pyrimidine | E. R. SQUIBB & SONS, INC. (US) | 1978-02-07 | — | — | US | disclosed |