Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | FAAH | O00519 | 13/20 | 0.52 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.51 |
| ▸ | UNG | P13051 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10563388 | 1.00 | NPC1 (0.58) | NPC1RAB9ANR5A1TP53TSHR | |
| SCHEMBL8006745 | 1.00 | NPC1 (0.58) | NPC1RAB9ANR5A1TP53TSHR | |
| SCHEMBL2200281 | 1.00 | NPC1 (0.58) | NPC1RAB9ANR5A1TP53TSHR | |
| SCHEMBL5948125 | 1.00 | NPC1 (0.58) | NPC1RAB9ANR5A1TP53TSHR | |
| SCHEMBL2089955 | 1.00 | NPC1 (0.58) | NPC1RAB9ANR5A1TP53TSHR | |
| SCHEMBL8957600 | 1.00 | NPC1 (0.58) | NPC1RAB9ANR5A1TP53TSHR | |
| SCHEMBL2089557 | 0.98 | NPC1 (0.59) | NPC1RAB9ANR5A1TP53TSHR | |
| SCHEMBL7533701 | 0.95 | NPC1 (0.54) | NPC1RAB9ANR5A1TSHRFAAH | |
| SCHEMBL9101286 | 0.88 | MAPT (0.49) | NPC1RAB9ATSHRFAAH | |
| SCHEMBL7654166 | 0.83 | PLA2G2A (0.53) | NPC1RAB9ANR5A1TP53TSHR |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1189891-A1 | TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF | LION Bioscience AG (DE) | 2002-03-27 | — | — | EP | claimed |
| US-6362342-B1 | BIOSYNTHESIS; DRUG LIBRARIES | LION BIOSCIENCE AG (DE) | 2002-03-26 | — | — | US | claimed |
| WO-2001000594-A1 | TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF | LION BIOSCIENCE AG (DE) | 2001-01-04 | — | — | WO | claimed |
| EP-1189891-A1 | TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF | LION Bioscience AG (DE) | 2002-03-27 | — | — | EP | disclosed |
| US-6362342-B1 | BIOSYNTHESIS; DRUG LIBRARIES | LION BIOSCIENCE AG (DE) | 2002-03-26 | — | — | US | disclosed |
| WO-2001000594-A1 | TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF | LION BIOSCIENCE AG (DE) | 2001-01-04 | — | — | WO | disclosed |