Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | NSD2 | O96028 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 3/20 | 0.33 |
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | TNKS | O95271 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | ACHE | P22303 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL14238855 | 0.89 | NPC1 (0.35) | METAP2NPC1RAB9ATDP1HCRTR1 | |
| SCHEMBL14239311 | 0.88 | NPC1 (0.36) | METAP2NPC1RAB9ATDP1HCRTR1 | |
| SCHEMBL14239349 | 0.88 | NPC1 (0.42) | METAP2NPC1RAB9ATDP1NSD2 | |
| SCHEMBL6922660 | 0.82 | AXL (0.35) | METAP2NPC1RAB9ATDP1NSD2 | |
| SCHEMBL14239422 | 0.82 | GRM5 (0.35) | NPC1RAB9ATDP1HCRTR1NSD2 | |
| SCHEMBL14238857 | 0.81 | METAP2 (0.34) | METAP2NPC1RAB9ATDP1NSD2 | |
| SCHEMBL14238856 | 0.81 | METAP2 (0.34) | METAP2NPC1RAB9ATDP1HCRTR1 | |
| SCHEMBL12059162 | 0.81 | MEN1 (0.49) | NPC1RAB9ATDP1NSD2TGFBR1 | |
| SCHEMBL14239313 | 0.81 | TGFBR1 (0.37) | METAP2NPC1RAB9ATDP1HCRTR1 | |
| SCHEMBL14239315 | 0.80 | TGFBR1 (0.35) | METAP2NPC1RAB9ATDP1HCRTR1 |
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 |