Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 2/20 | 0.35 |
| ▸ | USP30 | Q70CQ3 | 3/20 | 0.34 |
| ▸ | SMO | Q99835 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 5/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | PDE5A | O76074 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14239108 | 0.91 | SMO (0.39) | METAP2USP30SMOCYP3A4TGFBR1 | |
| SCHEMBL14239107 | 0.87 | USP30 (0.35) | METAP2USP30CYP3A4TGFBR1CHRNB2 | |
| SCHEMBL14240248 | 0.84 | SMO (0.36) | METAP2USP30SMOCYP3A4TGFBR1 | |
| SCHEMBL14239116 | 0.83 | NPC1 (0.36) | METAP2TGFBR1HCRTR1HCRTR2CHRNB2 | |
| SCHEMBL6922373 | 0.82 | MAPT (0.37) | METAP2USP30TGFBR1CNR2HRH3 | |
| SCHEMBL15818511 | 0.81 | POLB (0.36) | HCRTR1 | |
| SCHEMBL6923220 | 0.81 | MAPT (0.36) | METAP2USP30CYP3A4TGFBR1CHRNB2 | |
| SCHEMBL14239112 | 0.80 | METAP2 (0.35) | METAP2USP30TGFBR1HCRTR1HCRTR2 | |
| SCHEMBL14239044 | 0.80 | TGFBR1 (0.36) | METAP2USP30TGFBR1HCRTR1HCRTR2 | |
| SCHEMBL14238857 | 0.79 | METAP2 (0.34) | METAP2USP30TGFBR1CHRNB2CHRNB4 |
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-2012170845-A2 | METABOTROPIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS OF USE THEREOF | HEFFERNAN MICHELE L R (US) | 2012-12-13 | — | — | WO | disclosed |