Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PRCP | P42785 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | HTR2B | P41595 | 2/20 | 0.31 |
| ▸ | TLR2 | O60603 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7100699 | 0.79 | NOS2 (0.38) | CYP3A4CYP2D6CYP1A2CYP2C19PRCP | |
| Succinic Acid SCHEMBL15323280 | 0.79 | PRCP (0.38) | CYP3A4CYP2D6CYP1A2CYP2C19PRCP | |
| SCHEMBL708271 | 0.79 | — | — | |
| SCHEMBL118100 | 0.79 | — | — | |
| SCHEMBL51793 | 0.79 | — | — | |
| Glycine SCHEMBL15798104 | 0.78 | CYP3A4 (0.41) | CYP3A4CYP2D6CYP1A2CYP2C19PRCP | |
| Benzene SCHEMBL28130280 | 0.77 | CYP3A4 (0.51) | CYP3A4CYP2D6CYP1A2CYP2C19PRCP | |
| Hydrochloric Acid SCHEMBL190501 | 0.77 | CYP3A4 (0.44) | CYP3A4CYP2D6CYP1A2CYP2C19PRCP | |
| Methane SCHEMBL28919172 | 0.77 | CYP3A4 (0.44) | CYP3A4CYP2D6CYP1A2CYP2C19PRCP | |
| Water SCHEMBL16400402 | 0.77 | CYP3A4 (0.44) | CYP3A4CYP2D6CYP1A2CYP2C19PRCP |
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 |
|---|---|---|---|---|---|---|---|
| EP-2836833-A1 | PRENATAL SCREENING FOR DOWN SYNDROME AND TRISOMY 18 | Wayne State University (US) | 2015-02-18 | — | — | EP | disclosed |
| WO-2013155456-A1 | PRENATAL SCREENING FOR DOWN SYNDROME AND TRISOMY 18 | WAYNE STATE UNIVERSITY (US) | 2013-10-17 | — | — | WO | disclosed |