Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.37 |
| ▸ | PRCP | P42785 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | KDM1A | O60341 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12486539 | 0.84 | BCHE (0.45) | BCHEKDM4EMEN1MAPTPKM | |
| SCHEMBL12485441 | 0.80 | SLC22A1 (0.43) | SLC22A1PRCPKDM1ADRD2DRD4 | |
| SCHEMBL4709300 | 0.79 | SLC22A1 (0.59) | SLC22A1PRCPKDM1A | |
| SCHEMBL12485294 | 0.75 | SLC22A1 (0.42) | SLC22A1PRCPKDM1ADRD2DRD4 | |
| SCHEMBL12485208 | 0.73 | SLC22A1 (0.37) | SLC22A1PRCPKDM1ADRD2DRD4 | |
| SCHEMBL12484520 | 0.73 | BCHE (0.54) | BCHEKDM4EMAPTPKM | |
| SCHEMBL12486551 | 0.72 | CHRM4 (0.53) | OPRM1DRD2TBXA2R | |
| Hydrochloric Acid SCHEMBL12484284 | 0.72 | SLC22A1 (0.36) | SLC22A1PRCPKDM1ADRD2DRD4 | |
| SCHEMBL12486444 | 0.72 | GAA (0.37) | SLC22A1PRCPKDM1ADRD2DRD4 | |
| SCHEMBL1364766 | 0.72 | L3MBTL1 (0.43) | HTR2CKDM1ATBXA2R |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012114252-A1 | NOVEL INDOLE AND PYRROLOPYRIDINE AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-08-30 | — | — | WO | disclosed |