Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | SLC26A4 | O43511 | 5/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CCR4 | P51679 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL12470902 | 0.73 | NPC1 (0.48) | ALDH1A1HPGDLMNARAB9ASMN1; SMN2 | |
| SCHEMBL27911689 | 0.72 | SLC26A4 (0.54) | ALDH1A1HPGDLMNASMN1; SMN2SLC26A4 | |
| SCHEMBL29104693 | 0.71 | LMNA (0.46) | ALDH1A1HPGDLMNARAB9ASMN1; SMN2 | |
| SCHEMBL17912486 | 0.71 | MEN1 (0.51) | ALDH1A1HPGDLMNARAB9ASMN1; SMN2 | |
| SCHEMBL17912483 | 0.71 | EYA3 (0.48) | ALDH1A1HPGDLMNARAB9ASMN1; SMN2 | |
| SCHEMBL5564315 | 0.71 | AKR1B1 (0.54) | ALDH1A1HPGDLMNAMAPK1KDM4E | |
| SCHEMBL24470616 | 0.70 | HTT (0.64) | ALDH1A1HPGDLMNASMN1; SMN2SLC26A4 | |
| SCHEMBL29630216 | 0.70 | HTT (0.64) | ALDH1A1HPGDLMNASMN1; SMN2SLC26A4 | |
| SCHEMBL2083566 | 0.70 | ALDH1A1 (0.54) | ALDH1A1HPGDLMNASMN1; SMN2CA12 | |
| SCHEMBL15020090 | 0.69 | LMNA (0.64) | LMNASMN1; SMN2SLC26A4KMT2AMEN1 |
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-2012049555-A1 | SPIROCYCLIC COMPOUNDS AS VOLTAGE-GATED SODIUM CHANNEL MODULATORS | LUPIN LIMITED (IN) | 2012-04-19 | — | — | WO | disclosed |