Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 3/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.47 |
| ▸ | HTR1A | P08908 | 2/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.47 |
| ▸ | DRD1 | P21728 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.47 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.47 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6947716 | 0.98 | HDAC3 (0.50) | BCHEOPRM1ALDH1A1TSHROPRD1 | |
| SCHEMBL29151407 | 0.96 | OPRM1 (0.49) | BCHEOPRM1ALDH1A1TSHROPRD1 | |
| Hydrochloric Acid SCHEMBL1593455 | 0.96 | HDAC3 (0.49) | BCHEOPRM1ALDH1A1TSHROPRD1 | |
| SCHEMBL6947911 | 0.91 | HDAC3 (0.53) | BCHEOPRM1OPRD1CHRM2HTR1A | |
| SCHEMBL11194497 | 0.90 | KCNH2 (0.56) | BCHEOPRM1CHRM2HTR1AADRA2A | |
| SCHEMBL6944690 | 0.90 | HDAC3 (0.54) | BCHEOPRM1OPRD1KCNH2HDAC3 | |
| SCHEMBL373667 | 0.86 | OPRM1 (0.48) | OPRM1ALDH1A1TSHROPRD1SMN1; SMN2 | |
| SCHEMBL479112 | 0.84 | OPRM1 (0.47) | OPRM1ALDH1A1TSHROPRD1SMN1; SMN2 | |
| Bromide SCHEMBL8961491 | 0.84 | OPRM1 (0.47) | OPRM1ALDH1A1TSHROPRD1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL144177 | 0.84 | OPRM1 (0.50) | OPRM1ALDH1A1TSHROPRD1SMN1; SMN2 |
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-0474323-A1 | Reducing chelants, their complexes with technetium and rhenium, method for their preparation and their use in diagnosis and therapy | INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH, c/o FU KLINIKUM RUDOLF VIRCHOW (DE) | 1992-03-11 | — | — | EP | disclosed |