Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 5/20 | 0.59 |
| ▸ | HTR3A | P46098 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.50 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.48 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.47 |
| ▸ | FLT3 | P36888 | 3/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.46 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | WNT1 | P04628 | 2/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.43 |
| ▸ | EPHB3 | P54753 | 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 | |
|---|---|---|---|---|
| SCHEMBL4384530 | 0.80 | NPC1 (0.82) | CHRNA7HTR3ANPC1RAB9ASMYD3 | |
| SCHEMBL7378117 | 0.78 | NPC1 (0.71) | CHRNA7HTR3ANPC1RAB9ASMYD3 | |
| SCHEMBL2086463 | 0.77 | CHRNA7 (0.61) | CHRNA7HTR3ANPC1RAB9ASMYD3 | |
| Hydrochloric Acid SCHEMBL2085876 | 0.76 | CHRNA7 (0.60) | CHRNA7HTR3ANPC1RAB9ASMYD3 | |
| Facinicline SCHEMBL29749748 | 0.74 | CHRNA7 (1.00) | CHRNA7HTR3ANPC1RAB9ASMYD3 | |
| Facinicline SCHEMBL45329 | 0.74 | CHRNA7 (1.00) | CHRNA7HTR3ANPC1RAB9ASMYD3 | |
| Facinicline SCHEMBL45698 | 0.74 | CHRNA7 (1.00) | CHRNA7HTR3ANPC1RAB9ASMYD3 | |
| Facinicline SCHEMBL260422 | 0.74 | CHRNA7 (1.00) | CHRNA7HTR3ANPC1RAB9ASMYD3 | |
| Facinicline SCHEMBL29365997 | 0.74 | CHRNA7 (1.00) | CHRNA7HTR3ANPC1RAB9ASMYD3 | |
| Facinicline SCHEMBL260915 | 0.74 | CHRNA7 (0.98) | CHRNA7HTR3ANPC1RAB9ASMYD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1742944-B1 | INDOLES, 1H-INDAZOLES, 1,2-BENZISOXAZOLES, 1,2-BENZOISOTHIAZOLES, AND PREPARATION AND USES THEREOF | MEMORY PHARM CORP (US) | 2010-11-10 | — | — | EP | disclosed |