Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PPM1B | O75688 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20938370 | 1.00 | NPC1 (0.48) | NPC1POLBPPM1BCHRNB2CHRNA5 | |
| SCHEMBL13871574 | 0.96 | NPC1 (0.49) | NPC1POLBPPM1BCHRNB2CHRNA5 | |
| SCHEMBL5385400 | 0.96 | NPC1 (0.49) | NPC1POLBPPM1BCHRNB2CHRNA5 | |
| SCHEMBL5385406 | 0.96 | NPC1 (0.49) | NPC1POLBPPM1BCHRNB2CHRNA5 | |
| SCHEMBL4613728 | 0.96 | NPC1 (0.49) | NPC1POLBPPM1BCHRNB2CHRNA5 | |
| SCHEMBL14593729 | 0.96 | NPC1 (0.49) | NPC1POLBPPM1BCHRNB2CHRNA5 | |
| SCHEMBL29329361 | 0.96 | NPC1 (0.49) | NPC1POLBPPM1BCHRNB2CHRNA5 | |
| SCHEMBL4858609 | 0.96 | NPC1 (0.49) | NPC1POLBPPM1BCHRNB2CHRNA5 | |
| SCHEMBL14627118 | 0.96 | NPC1 (0.49) | NPC1POLBPPM1BCHRNB2CHRNA5 | |
| SCHEMBL14404525 | 0.92 | NPC1 (0.46) | NPC1POLBPPM1BABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0450102-A1 | NUCLEOSIDE DERIVATIVE | Yamasa Shoyu Kabushiki Kaisha (JP) | 1991-10-09 | — | — | EP | disclosed |