Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 3/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL91717 | 0.83 | ERN1 (0.43) | ALDH1A1L3MBTL1AKR1C3AKR1C2KMT2A | |
| SCHEMBL91720 | 0.80 | KMT2A (0.39) | LMNASMN1; SMN2KMT2AMEN1NPC1 | |
| SCHEMBL91791 | 0.80 | KIF11 (0.35) | ALDH1A1ESR1MAPTCYP1A2CYP2C19 | |
| SCHEMBL91705 | 0.80 | MAPT (0.41) | ALDH1A1AKR1C3AKR1C2KMT2AMEN1 | |
| SCHEMBL17356409 | 0.79 | MAPT (0.40) | LMNAHTTSMN1; SMN2ALDH1A1NOTUM | |
| SCHEMBL91827 | 0.77 | LMNA (0.34) | LMNAHTTSMN1; SMN2ALDH1A1L3MBTL1 | |
| SCHEMBL91721 | 0.75 | S1PR1 (0.38) | PDE3BPDE3AAKR1C3AKR1C2NOTUM | |
| SCHEMBL91700 | 0.75 | S1PR1 (0.43) | PDE3BPDE3AAKR1C3AKR1C2NOTUM | |
| SCHEMBL18948624 | 0.74 | S1PR1 (0.48) | PDE3BPDE3AAKR1C3AKR1C2NOTUM | |
| SCHEMBL28232101 | 0.73 | KIF11 (0.60) | PDE3BPDE3AKMT2AMEN1NOTUM |
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 |
|---|---|---|---|---|---|---|---|
| US-8129002-B2 | Compounds for use in liquid crystal media | MERCK PATENT GMBH (DE) | 2012-03-06 | — | — | US | disclosed |