Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.37 |
| ▸ | CHRNG | P07510 | 1/20 | 0.37 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | CHRND | Q07001 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3172917 | 0.85 | HTT (0.44) | MEN1KMT2ANPC1RAB9ATSHR | |
| SCHEMBL3163695 | 0.85 | SMN1; SMN2 (0.41) | KCNN4MEN1KMT2ANPC1RAB9A | |
| SCHEMBL7472692 | 0.82 | CNR1 (0.51) | KCNN4HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL3181871 | 0.81 | TSHR (0.42) | KCNN4MEN1KMT2AHPGDTSHR | |
| SCHEMBL31560823 | 0.81 | HDAC3 (0.42) | KCNN4HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL3169534 | 0.79 | RAB9A (0.44) | KCNN4MEN1KMT2ANPC1RAB9A | |
| SCHEMBL3173332 | 0.77 | KCNN4 (0.50) | KCNN4MEN1KMT2AHDAC3HDAC1 | |
| SCHEMBL523840 | 0.77 | KCNN4 (0.51) | KCNN4HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL29798913 | 0.77 | KCNN4 (0.51) | KCNN4HDAC3HDAC1HDAC2HDAC6 | |
| Bromomethane SCHEMBL209035 | 0.76 | KCNN4 (0.47) | KCNN4HDAC3HDAC1HDAC2HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104024244-A | Heterocyclic compounds, medicaments containing said compounds, their use and processes for their preparation | BOEHRINGER INGELHEIM INT | 2014-09-03 | — | — | CN | disclosed |