Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL787316 | 0.78 | SCN9A (0.54) | MAPTTHRBCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1200252 | 0.73 | GABRA2 (0.55) | MAPTCYP1A2GABRA2GABRB2L3MBTL1 | |
| SCHEMBL3327719 | 0.65 | CYP1A2 (0.61) | MAPTCYP1A2GABRA2GABRB2L3MBTL1 | |
| SCHEMBL30925060 | 0.63 | MAPT (0.56) | MAPTTHRBCYP1A2GABRA2GABRB2 | |
| SCHEMBL29214329 | 0.63 | MAPT (0.56) | MAPTTHRBCYP1A2GABRA2GABRB2 | |
| SCHEMBL4305339 | 0.63 | L3MBTL1 (0.46) | MAPTCYP1A2GABRA2GABRB2L3MBTL1 | |
| SCHEMBL25275643 | 0.62 | PIK3C3 (0.44) | GABRA2GABRB2 | |
| SCHEMBL31127029 | 0.61 | CYP1A2 (0.51) | MAPTCYP1A2GABRA2GABRB2L3MBTL1 | |
| SCHEMBL787591 | 0.61 | CYP1A2 (0.51) | MAPTCYP1A2GABRA2GABRB2L3MBTL1 | |
| SCHEMBL2823510 | 0.61 | CYP1A2 (0.51) | MAPTTHRBCYP1A2GABRA2GABRB2 |
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-2012035421-A2 | PYRIDINE COMPOUNDS AND THE USES THEREOF | PURDUE PHARMA L.P. (US) | 2012-03-22 | — | — | WO | disclosed |