Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 12/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14966545 | 0.85 | KLKB1 (0.41) | KLKB1RAB9AHTTSMN1; SMN2KDM4E | |
| SCHEMBL14966659 | 0.82 | LMNA (0.48) | KLKB1RAB9ASMN1; SMN2HPGDHSD17B10 | |
| SCHEMBL14967198 | 0.82 | SLC6A5 (0.44) | KLKB1RAB9AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL14966827 | 0.80 | SMN1; SMN2 (0.43) | KLKB1RAB9AHTTSMN1; SMN2KDM4E | |
| SCHEMBL14966442 | 0.80 | KLKB1 (0.41) | KLKB1RAB9AHTTSMN1; SMN2ALDH1A1 | |
| SCHEMBL14967341 | 0.80 | MEN1 (0.40) | KLKB1RAB9AHTTSMN1; SMN2CNR1 | |
| SCHEMBL14966965 | 0.79 | NPC1 (0.47) | KLKB1RAB9ASMN1; SMN2HPGDHSD17B10 | |
| SCHEMBL14966630 | 0.79 | KLKB1 (0.41) | KLKB1SMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL14966509 | 0.79 | KLKB1 (0.50) | KLKB1ALDH1A1HPGDOPRM1OPRK1 | |
| SCHEMBL14967152 | 0.78 | KDM4E (0.43) | KLKB1RAB9AHTTSMN1; SMN2KDM4E |
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 |