Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SETDB1 | Q15047 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12366130 | 0.88 | NPC1 (0.56) | NPC1RAB9AP2RX7L3MBTL1SMN1; SMN2 | |
| SCHEMBL12366090 | 0.81 | ALDH1A1 (0.57) | NPC1RAB9AP2RX7L3MBTL1SMN1; SMN2 | |
| SCHEMBL12366100 | 0.78 | ALDH1A1 (0.56) | NPC1RAB9AL3MBTL1SMN1; SMN2LMNA | |
| SCHEMBL12366176 | 0.77 | NR1H4 (0.46) | NPC1RAB9AL3MBTL1LMNAHTT | |
| SCHEMBL12366162 | 0.77 | P2RX7 (0.54) | NPC1RAB9AP2RX7SMN1; SMN2ALDH1A1 | |
| SCHEMBL12366093 | 0.76 | MMP13 (0.52) | NPC1RAB9ASMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL12366173 | 0.76 | P2RX7 (0.52) | NPC1RAB9AP2RX7L3MBTL1KDM4C | |
| SCHEMBL2264102 | 0.76 | NPC1 (0.52) | NPC1RAB9AP2RX7L3MBTL1KDM4C | |
| SCHEMBL11872322 | 0.76 | NPC1 (0.52) | NPC1RAB9AP2RX7L3MBTL1KDM4C | |
| SCHEMBL1520513 | 0.76 | NPC1 (0.59) | NPC1RAB9AP2RX7L3MBTL1KDM4C |
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 |