Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KLKB1 | P03952 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | HPGD | P15428 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14966781 | 0.90 | RAB9A (0.47) | SMN1; SMN2NPC1RAB9AKLKB1ALDH1A1 | |
| SCHEMBL14966442 | 0.88 | KLKB1 (0.41) | SMN1; SMN2NPC1RAB9AKLKB1ALDH1A1 | |
| SCHEMBL14966991 | 0.85 | LMNA (0.48) | SMN1; SMN2NPC1RAB9AKLKB1ALDH1A1 | |
| SCHEMBL14966808 | 0.83 | KLKB1 (0.51) | SMN1; SMN2KLKB1ALDH1A1HPGDKDM4E | |
| SCHEMBL14966464 | 0.81 | KLKB1 (0.40) | KLKB1MEN1KMT2A | |
| SCHEMBL14966646 | 0.81 | KLKB1 (0.46) | SMN1; SMN2KLKB1HPGDHTT | |
| SCHEMBL14972066 | 0.81 | KLKB1 (0.44) | SMN1; SMN2KLKB1ALDH1A1HPGDKDM4E | |
| SCHEMBL14966917 | 0.81 | KLKB1 (0.44) | SMN1; SMN2KLKB1ALDH1A1HPGDKDM4E | |
| SCHEMBL14966902 | 0.81 | KLKB1 (0.44) | SMN1; SMN2KLKB1ALDH1A1HPGDKDM4E | |
| SCHEMBL16344682 | 0.79 | HPGD (0.48) | KLKB1ALDH1A1HPGDKDM4EHSD17B10 |
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 |