Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.73 |
| ▸ | MC4R | P32245 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | LTA4H | P09960 | 1/20 | 0.55 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.53 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | GRM5 | P41594 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2485451 | 1.00 | CYP2D6 (0.73) | CYP2D6MC4RALDH1A1CYP3A4TSHR | |
| Hydrochloric Acid SCHEMBL28177303 | 0.98 | CYP2D6 (0.70) | CYP2D6MC4RALDH1A1CYP3A4TSHR | |
| SCHEMBL6706135 | 0.85 | CYP2D6 (1.00) | CYP2D6MC4RALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL7264542 | 0.85 | CYP2D6 (1.00) | CYP2D6MC4RALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL16226061 | 0.85 | CYP2D6 (1.00) | CYP2D6MC4RALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL23850144 | 0.81 | CYP2D6 (0.83) | CYP2D6MC4RALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL30364156 | 0.81 | CYP2D6 (0.83) | CYP2D6MC4RALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL8983562 | 0.81 | CYP2D6 (0.83) | CYP2D6MC4RALDH1A1CYP3A4TSHR | |
| SCHEMBL8983627 | 0.81 | CYP2D6 (0.83) | CYP2D6MC4RALDH1A1CYP3A4TSHR | |
| SCHEMBL7097730 | 0.81 | CYP2D6 (0.83) | CYP2D6MC4RALDH1A1CYP3A4TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3091012-B1 | CCR2 RECEPTOR ANTAGONISTS AND USES THEREOF | CENTREXION THERAPEUTICS CORP (US) | 2018-04-11 | — | — | EP | disclosed |
| EP-1910320-A2 | INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF | Mitsubishi Tanabe Pharma Corporation (JP) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007011065-A2 | INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2007-01-25 | — | — | WO | disclosed |