Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 6/20 | 0.41 |
| ▸ | MAOB | P27338 | 4/20 | 0.41 |
| ▸ | PTGIR | P43119 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.34 |
| ▸ | MGLL | Q99685 | 2/20 | 0.33 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7206793 | 0.95 | BCHE (0.39) | BCHEMAOBPTGIRNPC1ALDH1A1 | |
| SCHEMBL7208761 | 0.95 | BCHE (0.39) | BCHEMAOBPTGIRNPC1ALDH1A1 | |
| SCHEMBL7206536 | 0.80 | SMN1; SMN2 (0.39) | BCHEMAOBNPC1ALDH1A1TSHR | |
| SCHEMBL7212661 | 0.80 | CSNK2A2 (0.37) | TSHREGLN2 | |
| SCHEMBL7204740 | 0.78 | TSHR (0.38) | NPC1ALDH1A1TSHRRAB9ASMN1; SMN2 | |
| SCHEMBL3825844 | 0.78 | LMNA (0.41) | NPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL7211153 | 0.76 | KDM4E (0.30) | ALDH1A1TSHR | |
| SCHEMBL7212676 | 0.76 | RAF1 (0.33) | — | |
| SCHEMBL7207482 | 0.75 | LMNA (0.35) | BCHEALDH1A1RAB9ASMN1; SMN2ACHE | |
| SCHEMBL7205833 | 0.74 | ALDH1A1 (0.42) | ALDH1A1TSHRSMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1060183-B1 | 5'-DEOXYCYTIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2003-04-23 | — | — | EP | disclosed |
| EP-1060183-A1 | 5'-DEOXYCYTIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2000-12-20 | — | — | EP | disclosed |
| WO-1999040099-A1 | 5'-DEOXYCYTIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1999-08-12 | — | — | WO | disclosed |