Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 2/20 | 0.42 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.42 |
| ▸ | HPD | P32754 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2236840 | 0.86 | DRD4 (0.49) | NPC1RAB9AAKR1B1MEN1KMT2A | |
| SCHEMBL8102862 | 0.83 | NPC1 (0.56) | PDPK1NPC1RAB9AHPDKDM1A | |
| SCHEMBL20360954 | 0.81 | MAOB (0.47) | NPC1RAB9ATAAR1MEN1KMT2A | |
| SCHEMBL14967099 | 0.81 | KCNA3 (0.42) | NPC1RAB9ATAAR1KCNA3LTA4H | |
| SCHEMBL14967564 | 0.81 | ALDH1A1 (0.43) | NPC1RAB9ATAAR1KCNA3MEN1 | |
| SCHEMBL14966652 | 0.77 | PKM (0.61) | RAB9AKMT2A | |
| SCHEMBL20361470 | 0.76 | MAPT (0.43) | NPC1RAB9ATAAR1KDM1AMEN1 | |
| SCHEMBL12811048 | 0.76 | NPC1 (0.51) | PDPK1NPC1TAAR1KDM1AAKR1B1 | |
| SCHEMBL27569966 | 0.76 | CHRNB2 (0.44) | NPC1RAB9AMEN1KMT2A | |
| SCHEMBL8417765 | 0.74 | KCNA3 (0.61) | NPC1RAB9ATAAR1KCNA3LTA4H |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2780014-A1 | MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF | Constellation Pharmaceuticals, Inc. (US) | 2014-09-24 | — | — | EP | disclosed |
| WO-2013075083-A1 | MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF | CONSTELLATION PHARMACEUTICALS (US) | 2013-05-23 | — | — | WO | disclosed |