Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4271755 | 0.93 | LMNA (0.46) | ALDH1A1CYP3A4CYP2C9KDM4EMAPT | |
| SCHEMBL5065803 | 0.85 | LMNA (0.58) | ALDH1A1LMNASMN1; SMN2HTTPOLB | |
| SCHEMBL10335011 | 0.81 | MEN1 (0.57) | ALDH1A1CYP3A4HIF1APOLBMEN1 | |
| SCHEMBL4279870 | 0.79 | ALDH1A1 (0.52) | ALDH1A1CYP3A4CYP2C9KDM4EMAPT | |
| SCHEMBL4271439 | 0.74 | DRD2 (0.46) | ALDH1A1KDM4EMAPTLMNASMN1; SMN2 | |
| SCHEMBL4275831 | 0.74 | NPC1 (0.71) | ALDH1A1CYP3A4KMT2ANPC1CYP2D6 | |
| SCHEMBL4275876 | 0.71 | CACNA2D1 (0.73) | TDP1POLBCYP2D6 | |
| SCHEMBL4278641 | 0.71 | CA12 (0.46) | ALDH1A1CYP3A4CYP2C9KDM4EMAPT | |
| SCHEMBL1088276 | 0.71 | CYP2D6 (0.78) | ALDH1A1CYP3A4CYP2C9KDM4ELMNA | |
| SCHEMBL11374977 | 0.71 | LMNA (0.70) | ALDH1A1CYP3A4CYP2C9KDM4EMAPT |
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-2007071035-A1 | HETEROCYCLIC AMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | NEUROMED PHARMACEUTICALS LTD. (CA) | 2007-06-28 | — | — | WO | disclosed |