Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.40 |
| ▸ | ATR | Q13535 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CCNC | P24863 | 2/20 | 0.36 |
| ▸ | CDK8 | P49336 | 2/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.36 |
| ▸ | UBE2N | P61088 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 2/20 | 0.35 |
| ▸ | BCR | P11274 | 2/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12390414 | 0.91 | GRIN2B (0.46) | GRIN2BHPGDKDM1A | |
| SCHEMBL12390628 | 0.88 | RXRA (0.44) | KCNH2GRIN2BATRHPGDCCNC | |
| SCHEMBL12366784 | 0.88 | GRIN2B (0.41) | KCNH2GRIN2BATRHPGDCCNC | |
| Hydrochloric Acid SCHEMBL2268439 | 0.88 | RXRA (0.44) | KCNH2GRIN2BATRHPGDCCNC | |
| SCHEMBL12390411 | 0.86 | GRIN2B (0.40) | GRIN2BABL1BCRKDM1A | |
| SCHEMBL12390420 | 0.85 | ALDH1A1 (0.40) | GRIN2B | |
| SCHEMBL12390195 | 0.82 | MAPT (0.42) | — | |
| SCHEMBL12390408 | 0.80 | F2 (0.38) | — | |
| SCHEMBL2262542 | 0.80 | RXRA (0.46) | GRIN2BHPGDKDM1A | |
| SCHEMBL12366778 | 0.79 | GRIN2B (0.46) | GRIN2BHPGDKDM1A |
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 |
|---|---|---|---|---|---|---|---|
| US-7998986-B2 | Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors | EXELIXIS PATENT COMPANY LLC (US) | 2011-08-16 | — | — | US | disclosed |