Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.38 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | CTSD | P07339 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | RET | P07949 | 2/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.35 |
| ▸ | PKMYT1 | Q99640 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.34 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.34 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.34 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12059073 | 0.82 | NPC1 (0.40) | CYP3A4PIK3CDPIK3CAPIK3CGPIK3CB | |
| SCHEMBL14238838 | 0.80 | POLB (0.44) | KMT2A | |
| SCHEMBL6920771 | 0.80 | KDM4E (0.39) | CYP3A4PIK3CDPIK3CAPIK3CGPIK3CB | |
| SCHEMBL6922413 | 0.80 | NPC1 (0.43) | KMT2ACYP3A4PIK3CDPIK3CAPIK3CG | |
| SCHEMBL6922591 | 0.80 | CYP3A4 (0.41) | CYP3A4PIK3CDPIK3CAPIK3CGPIK3CB | |
| SCHEMBL6923262 | 0.78 | RAB9A (0.46) | KMT2ACYP3A4 | |
| SCHEMBL6921660 | 0.78 | CYP3A4 (0.38) | CYP3A4PIK3CDPIK3CAPIK3CGPIK3CB | |
| SCHEMBL15818032 | 0.78 | KMT2A (0.39) | KMT2APIK3CDPIK3CAPIK3CGPIK3CB | |
| SCHEMBL14239415 | 0.78 | RAB9A (0.41) | CYP3A4PIK3CDPIK3CAPIK3CGPIK3CB | |
| SCHEMBL6921117 | 0.78 | CYP3A4 (0.37) | CYP3A4PIK3CDPIK3CAPIK3CGPIK3CB |
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 |