Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5985811 | 0.97 | TSHR (0.43) | NPC1ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL5985327 | 0.92 | NPC1 (0.44) | NPC1ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL13134778 | 0.84 | NPC1 (0.50) | NPC1ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL21449552 | 0.83 | NPC1 (0.49) | NPC1ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL7796314 | 0.80 | NPC1 (0.40) | NPC1ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL18643856 | 0.77 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2SGPL1S1PR1 | |
| SCHEMBL5986329 | 0.75 | LMNA (0.35) | NPC1ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL7795156 | 0.72 | LMNA (0.35) | NPC1ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL16692536 | 0.72 | TSHR (0.53) | NPC1ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL2563770 | 0.70 | LMNA (0.45) | NPC1ALDH1A1TSHRRAB9ASMN1; SMN2 |
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-2010150840-A1 | N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE | 大日本住友製薬株式会社 (JP) | 2010-12-29 | — | — | WO | disclosed |