Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | TSHR | P16473 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.53 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.53 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.53 |
| ▸ | HTR2A | P28223 | 2/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.53 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.53 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.53 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.53 |
| ▸ | ESR1 | P03372 | 1/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL15356052 | 0.84 | TSHR (0.55) | ALDH1A1TSHRSMN1; SMN2OPRD1ADRA2B | |
| SCHEMBL9110973 | 0.79 | TSHR (0.62) | ALDH1A1TSHRSMN1; SMN2OPRD1ADRA2B | |
| SCHEMBL8987668 | 0.76 | OPRD1 (0.44) | ALDH1A1TSHROPRD1NPSR1KMT2A | |
| SCHEMBL8987693 | 0.75 | OPRD1 (0.52) | SMN1; SMN2OPRD1ADRA1ASLC6A3SIGMAR1 | |
| SCHEMBL373667 | 0.73 | OPRM1 (0.48) | ALDH1A1TSHRSMN1; SMN2OPRD1ADRA2B | |
| SCHEMBL20694811 | 0.73 | TSHR (0.55) | ALDH1A1TSHRSMN1; SMN2OPRD1ADRA2B | |
| SCHEMBL479112 | 0.71 | OPRM1 (0.47) | ALDH1A1TSHRSMN1; SMN2OPRD1ADRA2B | |
| Hydrochloric Acid SCHEMBL144177 | 0.71 | OPRM1 (0.50) | ALDH1A1TSHRSMN1; SMN2OPRD1ADRA2B | |
| Bromide SCHEMBL8961491 | 0.71 | OPRM1 (0.47) | ALDH1A1TSHRSMN1; SMN2OPRD1ADRA2B | |
| SCHEMBL9513844 | 0.71 | HTR2A (0.45) | TSHRSMN1; SMN2OPRD1ADRA2BSLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6235730-B1 | ANTICHOLESTEROL AGENT, ANTILIPEMIC AGENT | JAPAN TOBACCO, INC. (JP) | 2001-05-22 | — | — | US | disclosed |
| EP-0970954-A1 | 3-PIPERIDYL-4-OXOQUINAZOLINE DERIVATIVES AND MEDICINCAL COMPOSITIONS CONTAINING THE SAME | JAPAN TOBACCO INC. (JP) | 2000-01-12 | — | — | EP | disclosed |