Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.41 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CBFB | Q13951 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | FLT1 | P17948 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MASP2 | O00187 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4107024 | 0.91 | BCHE (0.49) | BCHEACHEHTR3AALDH1A1KDM4E | |
| SCHEMBL3389271 | 0.77 | BCHE (0.56) | BCHEACHEHTR3AALDH1A1KDM4E | |
| SCHEMBL7479170 | 0.71 | MEN1 (0.43) | MAPTCBFBCYP11B1CYP11B2CYP3A4 | |
| SCHEMBL10593475 | 0.71 | IDO1 (0.47) | TP53RAB9AAURKANPC1SMN1; SMN2 | |
| SCHEMBL15084733 | 0.71 | NPC1 (0.39) | ACHERAB9AMAPTCBFBCYP11B1 | |
| SCHEMBL1055019 | 0.69 | CYP11B1 (0.46) | KDM4ETP53RAB9AMAPTCBFB | |
| SCHEMBL7016670 | 0.69 | MEN1 (0.39) | CBFBFGFR1FLT1CYP11B1CYP11B2 | |
| SCHEMBL11569434 | 0.69 | AURKA (0.49) | CBFBAURKACYP3A4HSD17B10ALKBH3 | |
| SCHEMBL9662962 | 0.67 | TBXAS1 (0.52) | CYP11B1CYP11B2 | |
| SCHEMBL7407358 | 0.66 | CBFB (0.50) | RAB9AMAPTCBFBFGFR1FLT1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102066384-B | Quinuclidine compounds as alpha-7 nicotinic acetylcholine receptor ligands | BRISTOL MYERS SQUIBB CO | 2014-07-30 | — | — | CN | disclosed |
| CN-102066384-A | Quinuclidine compounds as alpha-7 nicotinic acetylcholine receptor ligands | BRISTOL MYERS SQUIBB CO | 2011-05-18 | — | — | CN | disclosed |