Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | AURKA | O14965 | 2/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.46 |
| ▸ | F2 | P00734 | 2/20 | 0.46 |
| ▸ | F12 | P00748 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10999313 | 0.84 | CYP1A2 (0.53) | CYP1A2CYP3A4GAACYP2C19MAPK1 | |
| SCHEMBL678202 | 0.80 | LMNA (0.55) | CYP1A2CYP3A4GAACYP2C19MAPK1 | |
| SCHEMBL4977587 | 0.76 | CYP1A2 (0.51) | CYP1A2CYP3A4GAACYP2C19MAPK1 | |
| SCHEMBL6307534 | 0.76 | NPC1 (0.58) | CYP1A2CYP3A4GAACYP2C19MAPK1 | |
| SCHEMBL31060745 | 0.76 | NPC1 (0.58) | CYP1A2CYP3A4GAACYP2C19MAPK1 | |
| SCHEMBL3299661 | 0.75 | ADORA1 (0.70) | CYP1A2MAPK1HDAC3HDAC1HDAC2 | |
| SCHEMBL11831465 | 0.75 | MEN1 (0.64) | CYP1A2CYP3A4CYP2C19HDAC3HDAC1 | |
| SCHEMBL9564262 | 0.75 | ADORA1 (0.60) | CYP1A2CYP3A4GAACYP2C19MAPK1 | |
| SCHEMBL14439750 | 0.74 | NPC1 (0.61) | MAPK1HDAC3HDAC1HDAC2MEN1 | |
| SCHEMBL11087556 | 0.74 | CYP1A2 (0.52) | CYP1A2CYP3A4GAACYP2C19MAPK1 |
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-2012009258-A2 | PEPTIDOMIMETIC GALANIN RECEPTOR MODULATORS | ROBERTS EDWARD (US) | 2012-01-19 | — | — | WO | disclosed |