Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 5/20 | 0.71 |
| ▸ | HTR2B | P41595 | 5/20 | 0.71 |
| ▸ | MEN1 | O00255 | 3/20 | 0.71 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.71 |
| ▸ | USP2 | O75604 | 3/20 | 0.71 |
| ▸ | HTR7 | P34969 | 3/20 | 0.71 |
| ▸ | HTR6 | P50406 | 3/20 | 0.71 |
| ▸ | HTR2A | P28223 | 3/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.71 |
| ▸ | RGS12 | O14924 | 3/20 | 0.71 |
| ▸ | GNAI1 | P63096 | 3/20 | 0.71 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.71 |
| ▸ | TP53 | P04637 | 2/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.71 |
| ▸ | MAPT | P10636 | 2/20 | 0.71 |
| ▸ | TSHR | P16473 | 2/20 | 0.71 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.71 |
| ▸ | LMNA | P02545 | 2/20 | 0.71 |
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 | |
|---|---|---|---|---|
| SCHEMBL11321615 | 0.87 | CYP2D6 (0.67) | CYP2D6HTR2BMEN1KMT2AUSP2 | |
| SCHEMBL11321610 | 0.87 | CYP2D6 (0.67) | CYP2D6HTR2BMEN1KMT2AUSP2 | |
| SCHEMBL8211853 | 0.84 | HTR7 (0.71) | CYP2D6HTR2BMEN1KMT2AUSP2 | |
| Metergoline SCHEMBL117882 | 0.83 | HTR2B (1.00) | CYP2D6HTR2BMEN1KMT2AUSP2 | |
| Metergoline SCHEMBL15440536 | 0.83 | HTR2B (1.00) | CYP2D6HTR2BMEN1KMT2AUSP2 | |
| Metergoline SCHEMBL29392365 | 0.83 | HTR2B (1.00) | CYP2D6HTR2BMEN1KMT2AUSP2 | |
| Metergoline SCHEMBL19236127 | 0.83 | HTR2B (1.00) | CYP2D6HTR2BMEN1KMT2AUSP2 | |
| Metergoline SCHEMBL7631854 | 0.83 | HTR2B (1.00) | CYP2D6HTR2BMEN1KMT2AUSP2 | |
| SCHEMBL8209067 | 0.82 | HTR2B (0.84) | CYP2D6HTR2BMEN1KMT2AUSP2 | |
| SCHEMBL11724011 | 0.81 | HTR2B (0.80) | CYP2D6HTR2BMEN1KMT2AUSP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6026817-A | ADMINISTERING OPIATE ANTAGONIST BEFORE THERAPIC DRUG | NEURENDO PHARMA, LLC | 2000-02-22 | — | — | US | disclosed |