Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 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 | |
|---|---|---|---|---|
| SCHEMBL1714656 | 0.86 | NPC1 (0.46) | NPC1MAPTRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL12461086 | 0.86 | NPC1 (0.46) | NPC1MAPTRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL466674 | 0.80 | ADRA2A (0.41) | ADRA2AADRA2BADRA2C | |
| SCHEMBL12312809 | 0.74 | NPC1 (0.46) | NPC1MAPTRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL786360 | 0.74 | NPC1 (0.46) | NPC1MAPTRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL12312808 | 0.74 | NPC1 (0.46) | NPC1MAPTRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL23734239 | 0.71 | NPC1 (0.43) | NPC1MAPTRAB9ASMN1; SMN2MEN1 | |
| Bromide SCHEMBL5618997 | 0.71 | NPC1 (0.43) | NPC1MAPTRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL14231482 | 0.71 | NPC1 (0.43) | NPC1MAPTRAB9ASMN1; SMN2MEN1 | |
| SCHEMBL22626440 | 0.68 | NPC1 (0.41) | NPC1MAPTRAB9ASMN1; SMN2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1957454-B1 | METHODS FOR SYNTHESIS OF 3-AMINO-1-ARYLPROPYL INDOLES | HOFFMANN LA ROCHE (CH) | 2011-07-20 | — | — | EP | disclosed |