Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 5/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | ITK | Q08881 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10033121 | 0.89 | USP30 (0.38) | KDM1ATSHRUSP30NPC1RAB9A | |
| SCHEMBL10033001 | 0.87 | NPC1 (0.38) | NPC1RAB9AKMT2A | |
| SCHEMBL10033003 | 0.87 | EPHX2 (0.45) | NPC1RAB9AKMT2A | |
| SCHEMBL10033134 | 0.82 | USP30 (0.36) | KDM1AUSP30NPC1RAB9AGRIA4 | |
| SCHEMBL1709497 | 0.79 | EPHX2 (0.43) | USP30KMT2A | |
| SCHEMBL10033099 | 0.79 | CTSC (0.40) | KDM1AUSP30NPC1RAB9AGRIA4 | |
| SCHEMBL10033135 | 0.78 | KCNN4 (0.38) | EPHX1CTSDHDAC8HDAC6HDAC1 | |
| SCHEMBL1709374 | 0.77 | KMT2A (0.39) | RAB9AKMT2A | |
| SCHEMBL1709408 | 0.76 | DGAT1 (0.38) | — | |
| SCHEMBL1709407 | 0.76 | TP53 (0.39) | NPC1RAB9AEPHX1KMT2APAX8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |