Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.60 |
| ▸ | HTT | P42858 | 3/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | GSK3B | P49841 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.51 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL17845146 | 0.89 | NPC1 (0.55) | NPC1HTTLMNAMAPTKMT2A | |
| SCHEMBL457954 | 0.88 | NPC1 (0.73) | NPC1HTTLMNAMAPTKMT2A | |
| SCHEMBL1515877 | 0.88 | STS (0.56) | NPC1HTTLMNAMAPTRAB9A | |
| SCHEMBL21780777 | 0.85 | POLB (0.55) | NPC1HTTLMNAMAPTKMT2A | |
| SCHEMBL12188828 | 0.83 | MAPT (0.62) | NPC1HTTLMNAMAPTKMT2A | |
| SCHEMBL2938988 | 0.82 | NPC1 (0.42) | NPC1HTTLMNAMAPTKMT2A | |
| SCHEMBL3099733 | 0.82 | NPC1 (0.65) | NPC1HTTLMNAMAPTKMT2A | |
| SCHEMBL1420182 | 0.82 | NPC1 (0.65) | NPC1HTTLMNAMAPTKMT2A | |
| SCHEMBL3097303 | 0.82 | NPC1 (0.65) | NPC1HTTLMNAMAPTKMT2A | |
| SCHEMBL12637609 | 0.82 | NPC1 (0.65) | NPC1HTTLMNAMAPTKMT2A |
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-3233828-B1 | ESTROGEN RECEPTOR MODULATORS AND USES THEREOF | HOFFMANN LA ROCHE (CH) | 2020-03-04 | — | — | EP | disclosed |