Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10449764 | 1.00 | NPC1 (0.56) | NPC1CRBNLMNAMAPTPKM | |
| SCHEMBL10449763 | 1.00 | NPC1 (0.56) | NPC1CRBNLMNAMAPTPKM | |
| SCHEMBL10451008 | 0.99 | NPC1 (0.54) | NPC1CRBNLMNAMAPTPKM | |
| SCHEMBL10449462 | 0.99 | NPC1 (0.54) | NPC1CRBNLMNAMAPTPKM | |
| SCHEMBL10451148 | 0.99 | NPC1 (0.54) | NPC1CRBNLMNAMAPTPKM | |
| SCHEMBL10451106 | 0.99 | NPC1 (0.54) | NPC1CRBNLMNAMAPTPKM | |
| SCHEMBL10451149 | 0.99 | NPC1 (0.54) | NPC1CRBNLMNAMAPTPKM | |
| SCHEMBL10451005 | 0.99 | NPC1 (0.54) | NPC1CRBNLMNAMAPTPKM | |
| SCHEMBL10451110 | 0.99 | NPC1 (0.54) | NPC1CRBNLMNAMAPTPKM | |
| SCHEMBL10451145 | 0.99 | NPC1 (0.54) | NPC1CRBNLMNAMAPTPKM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4943384-A | LIQUID CRYSTALS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1990-07-24 | — | — | US | disclosed |
| EP-0216880-B1 | CYCLOHEXANE DERIVATIVES | MERCK PATENT GmbH (DE) | 1988-11-02 | — | — | EP | disclosed |