Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | NT5E | P21589 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7563853 | 0.81 | ALDH1A1 (0.33) | NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL7566181 | 0.71 | MEN1 (0.32) | KMT2AMEN1 | |
| SCHEMBL9096127 | 0.65 | TSHR (0.38) | ALDH1A1L3MBTL1 | |
| SCHEMBL7641953 | 0.65 | TSHR (0.38) | ALDH1A1L3MBTL1 | |
| SCHEMBL9094926 | 0.64 | LGALS8 (0.39) | MAPT | |
| SCHEMBL7152137 | 0.63 | NT5E (0.44) | NPC1RAB9AKMT2ALMNACRHBP | |
| SCHEMBL7744297 | 0.62 | LGALS9 (0.35) | KMT2ALMNASMN1; SMN2TP53ALDH1A1 | |
| SCHEMBL7744294 | 0.62 | LGALS9 (0.35) | KMT2ALMNASMN1; SMN2TP53ALDH1A1 | |
| SCHEMBL9445828 | 0.62 | CRHBP (0.45) | NPC1RAB9AKMT2ALMNAPOLB | |
| SCHEMBL16180090 | 0.62 | NEU3 (0.33) | KMT2ASMN1; SMN2ALDH1A1MAPTBCHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1615933-A2 | FUSED OXABICYCLIC AMINOALCOHOLS AS NEW SCAFFOLDS FOR COMBINATORIAL LIBRARIES | Pharmacia Italia S.p.A. (IT) | 2006-01-18 | — | — | EP | disclosed |
| WO-2004089277-A2 | FUSED OXABICYCLIC AMINOALCOHOLS AS NEW SCAFFOLDS FOR COMBINATORIAL LIBRARIES | PHARMACIA ITALIA S.P.A. (IT) | 2004-10-21 | — | — | WO | disclosed |