Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | MGAM | O43451 | 2/20 | 0.50 |
| ▸ | SI | P14410 | 1/20 | 0.50 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.50 |
| ▸ | GUSB | P08236 | 1/20 | 0.48 |
| ▸ | FLT3 | P36888 | 1/20 | 0.47 |
| ▸ | GSK3A | P49840 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.47 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | PDE5A | O76074 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2372869 | 0.84 | PTGES (0.51) | KDM4EHPGDHSD17B10GAAMGAM | |
| SCHEMBL31722934 | 0.83 | KDM4E (0.59) | KDM4EHPGDHSD17B10GAAMGAM | |
| SCHEMBL3111166 | 0.83 | KDM4E (0.59) | KDM4EHPGDHSD17B10GAAMGAM | |
| SCHEMBL4090569 | 0.78 | GUSB (0.70) | KDM4EHPGDHSD17B10GAAGUSB | |
| SCHEMBL296062 | 0.76 | GUSB (0.70) | KDM4EHPGDHSD17B10GUSBNPC1 | |
| SCHEMBL14141938 | 0.75 | HDAC6 (0.51) | KDM4EHPGDHSD17B10GAAGUSB | |
| SCHEMBL7602915 | 0.73 | ALDH1A1 (0.53) | KDM4EHPGDHSD17B10GAANPC1 | |
| SCHEMBL11245430 | 0.71 | NPC1 (0.50) | KDM4EHPGDHSD17B10GAAGUSB | |
| SCHEMBL17717642 | 0.70 | F2 (0.61) | KDM4EHPGDHSD17B10GAAMGAM | |
| SCHEMBL7398247 | 0.70 | AMY1A (0.71) | KDM4EHPGDHSD17B10GAAMGAM |
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-1828150-A2 | PROCESSES FOR PRODUCING 4-AMINOQUINAZOLINES | Vertex Pharmaceuticals Incorporated (US) | 2007-09-05 | — | — | EP | disclosed |
| WO-2006066044-A2 | PROCESSES FOR PRODUCING 4-AMINOQUINAZOLINES | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-06-22 | — | — | WO | disclosed |