Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | COMT | P21964 | 1/20 | 0.32 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.31 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.31 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28296692 | 0.82 | IDO1 (0.41) | IDO1ADRA1AADRA1BADRA1DCOMT | |
| SCHEMBL28296688 | 0.76 | SIGMAR1 (0.36) | SIGMAR1IDO1HRH4HRH3HTR1A | |
| SCHEMBL28294965 | 0.76 | PRKAB2 (0.38) | SIGMAR1IDO1HRH4HRH3CHRM2 | |
| SCHEMBL28296691 | 0.74 | PARP1 (0.40) | SIGMAR1CHRM2CHRM1CHRM4CHRM5 | |
| SCHEMBL30332563 | 0.68 | IDO1 (0.58) | IDO1ADRA1AADRA1BADRA1DCOMT | |
| SCHEMBL1147021 | 0.67 | PLA2G1B (0.59) | SIGMAR1CACNA2D1HRH4HRH3PLA2G1B | |
| SCHEMBL13061077 | 0.63 | SIGMAR1 (0.71) | SIGMAR1CACNA2D1ADRA1ACHRM2CHRM1 | |
| SCHEMBL15654271 | 0.63 | SIGMAR1 (0.71) | SIGMAR1CACNA2D1ADRA1ACHRM2CHRM1 | |
| SCHEMBL1147313 | 0.62 | PLA2G1B (0.56) | SIGMAR1CACNA2D1PLA2G1BPLA2G2A | |
| Hydrochloric Acid SCHEMBL9403964 | 0.62 | SIGMAR1 (0.69) | SIGMAR1CACNA2D1ADRA1ACHRM2CHRM1 |
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 |