Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.55 |
| ▸ | NPC1 | O15118 | 7/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.49 |
| ▸ | RELA | Q04206 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3190859 | 0.86 | SCN9A (0.56) | RAB9ANPC1TSHRSCN9ATP53 | |
| SCHEMBL4435799 | 0.78 | KCNQ3 (0.48) | RAB9ASMN1; SMN2SCN9AMAPTL3MBTL1 | |
| SCHEMBL4411279 | 0.76 | ALOX15 (0.43) | RAB9ANPC1SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL28764679 | 0.72 | L3MBTL1 (0.66) | RAB9ANPC1SMN1; SMN2TSHRTP53 | |
| SCHEMBL29837506 | 0.72 | L3MBTL1 (0.66) | RAB9ANPC1SMN1; SMN2TSHRTP53 | |
| SCHEMBL6772756 | 0.72 | GRM5 (0.62) | RAB9ANPC1SMN1; SMN2TSHRTP53 | |
| SCHEMBL7372031 | 0.71 | SMN1; SMN2 (0.64) | RAB9ANPC1SMN1; SMN2TSHRSCN9A | |
| SCHEMBL4272301 | 0.71 | GRM5 (0.61) | RAB9ANPC1SMN1; SMN2TSHRSCN9A | |
| SCHEMBL3185799 | 0.71 | SCN9A (0.50) | RAB9ANPC1SMN1; SMN2TSHRSCN9A | |
| SCHEMBL3901503 | 0.70 | GRM4 (0.60) | RAB9ANPC1SMN1; SMN2TSHRTP53 |
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-2009121036-A2 | SUBSTITUTED ARYL PYRIMIDINONE DERIVATIVES | NEUROGEN CORPORATION (US) | 2009-10-01 | — | — | WO | disclosed |