Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.57 |
| ▸ | RAB9A | P51151 | 9/20 | 0.57 |
| ▸ | NPC1 | O15118 | 8/20 | 0.57 |
| ▸ | LMNA | P02545 | 7/20 | 0.57 |
| ▸ | PKM | P14618 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 9/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.53 |
| ▸ | HTT | P42858 | 4/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | GMNN | O75496 | 1/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | MMP2 | P08253 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | MMP9 | P14780 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MMP8 | P22894 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7555211 | 1.00 | KDM4E (0.57) | KDM4ERAB9ANPC1LMNAPKM | |
| SCHEMBL12068215 | 1.00 | KDM4E (0.57) | KDM4ERAB9ANPC1LMNAPKM | |
| SCHEMBL17899331 | 0.89 | CCR1 (0.67) | KDM4ERAB9ANPC1LMNAMAPT | |
| SCHEMBL31300953 | 0.83 | KDM4E (0.57) | KDM4ERAB9ANPC1LMNAPKM | |
| SCHEMBL22501436 | 0.82 | RAB9A (0.65) | KDM4ERAB9ANPC1LMNAPKM | |
| SCHEMBL30494395 | 0.82 | RAB9A (0.65) | KDM4ERAB9ANPC1LMNAPKM | |
| SCHEMBL28443608 | 0.82 | RAB9A (0.80) | KDM4ERAB9ANPC1LMNAPKM | |
| SCHEMBL21323727 | 0.81 | L3MBTL1 (0.57) | KDM4ERAB9ANPC1LMNAPKM | |
| Quinoline SCHEMBL28850584 | 0.79 | RAB9A (0.81) | KDM4ERAB9ANPC1LMNAPKM | |
| Phenanthroline SCHEMBL27546799 | 0.78 | ALDH1A1 (0.77) | KDM4ERAB9ANPC1LMNAMAPT |
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-2576540-A2 | HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF | Sunovion Pharmaceuticals Inc. (US) | 2013-04-10 | — | — | EP | disclosed |
| WO-2011150156-A2 | HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF | SUNOVION PHARMACEUTICALS INC. (US) | 2011-12-01 | — | — | WO | disclosed |