Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPR | P35270 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.37 |
| ▸ | AVPR2 | P30518 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | AVPR1A | P37288 | 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 | |
|---|---|---|---|---|
| SCHEMBL5366609 | 0.86 | SPR (0.45) | SPRHDAC1HDAC6NPC1TTR | |
| SCHEMBL5331064 | 0.86 | SPR (0.45) | SPRHDAC1HDAC6NPC1TTR | |
| SCHEMBL5334692 | 0.84 | NOTUM (0.51) | SPRNPSR1CYP11B2 | |
| SCHEMBL14346538 | 0.76 | SPR (0.39) | SPRHDAC1HDAC6AVPR2HPGD | |
| SCHEMBL5363349 | 0.71 | SPR (0.35) | SPRNPC1TTRAVPR2KMT2A | |
| SCHEMBL5363352 | 0.71 | SPR (0.35) | SPRNPC1TTRHPGDMAPT | |
| SCHEMBL11714271 | 0.67 | NPC1 (0.61) | NPC1TTRMAPTKMT2A | |
| SCHEMBL9822279 | 0.64 | NOTUM (0.43) | SPRHDAC1HDAC6HPGDMAPT | |
| SCHEMBL5547425 | 0.64 | HDAC1 (0.61) | HDAC1HDAC6AVPR2KCNH2SMN1; SMN2 | |
| SCHEMBL10367966 | 0.64 | CES1 (0.62) | NPC1TTRMAPTMEN1KMT2A |
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-2007146230-A2 | NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS | MERCK & CO., INC. (US) | 2007-12-21 | — | — | WO | disclosed |