Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.49 |
| ▸ | RAB9A | P51151 | 8/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.46 |
| ▸ | RELA | Q04206 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27613702 | 0.88 | GRM5 (0.44) | NPC1RAB9ASMN1; SMN2ALDH1A1GRM5 | |
| SCHEMBL27613705 | 0.87 | MAPT (0.39) | NPC1RAB9ASMN1; SMN2ALDH1A1TP53 | |
| SCHEMBL27613696 | 0.86 | KCNH2 (0.43) | NPC1RAB9ASMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL27613597 | 0.86 | TP53 (0.40) | SMN1; SMN2ALDH1A1LMNAHPGDHTT | |
| SCHEMBL27613601 | 0.86 | KCNH2 (0.35) | NPC1RAB9ASMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL27613533 | 0.85 | KCNH2 (0.35) | NPC1RAB9ASMN1; SMN2ALDH1A1LMNA | |
| Ethoxycarbonyl Group SCHEMBL27613617 | 0.84 | NPC1 (0.47) | NPC1RAB9ASMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL27632658 | 0.83 | MAPT (0.46) | NPC1RAB9ASMN1; SMN2ALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL5958619 | 0.78 | KCNH2 (0.58) | NPC1RAB9ASMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL27632647 | 0.74 | KCNH2 (0.46) | NPC1RAB9ALMNAHPGDTSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1691944-A | Oxadiazoles as modulators of metabotropic glutamate receptor-5 | ASTRAZENECA AB (SE) | 2005-11-02 | — | — | CN | claimed |