Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | PDE9A | O76083 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 2/20 | 0.36 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28296688 | 0.90 | SIGMAR1 (0.36) | SIGMAR1 | |
| SCHEMBL28294965 | 0.89 | PRKAB2 (0.38) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL28296692 | 0.79 | IDO1 (0.41) | PDE9A | |
| SCHEMBL28684148 | 0.74 | KDM4E (0.44) | PARP1HTR7 | |
| SCHEMBL28294951 | 0.74 | SIGMAR1 (0.41) | SIGMAR1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL28306965 | 0.71 | SIGMAR1 (0.72) | POLBSIGMAR1 | |
| SCHEMBL30332563 | 0.65 | IDO1 (0.58) | POLBRAB9A | |
| SCHEMBL28162876 | 0.62 | SIGMAR1 (0.70) | POLBSIGMAR1 | |
| SCHEMBL23926333 | 0.62 | SIGMAR1 (0.61) | POLBSIGMAR1SMN1; SMN2KDM1A | |
| SCHEMBL15308540 | 0.62 | CYP2A13 (0.66) | POLBSIGMAR1SMN1; SMN2KDM1A |
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-109665987-A | Naphthalene lactim-polyamines conjugate and its preparation method and application | 河南大学 | 2019-04-23 | — | — | CN | disclosed |