Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.42 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.42 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1165535 | 0.78 | TSHR (0.56) | TSHRALDH1A1AOC3NPC1RAB9A | |
| SCHEMBL28178414 | 0.78 | ALDH1A1 (0.45) | TSHRALDH1A1AOC3NPC1RAB9A | |
| SCHEMBL16848072 | 0.74 | TSHR (0.56) | TSHRALDH1A1AOC3NPC1RAB9A | |
| SCHEMBL967208 | 0.74 | TSHR (0.56) | TSHRALDH1A1AOC3NPC1RAB9A | |
| SCHEMBL27917722 | 0.73 | LRRK2 (0.46) | TSHRALDH1A1NPC1RAB9ALMNA | |
| SCHEMBL8742976 | 0.72 | TSHR (0.54) | TSHRALDH1A1AOC3NPC1RAB9A | |
| SCHEMBL24688902 | 0.71 | ALDH1A1 (0.52) | TSHRALDH1A1AOC3NPC1RAB9A | |
| SCHEMBL2584302 | 0.71 | PYCR1 (0.66) | TSHRALDH1A1AOC3NPC1RAB9A | |
| SCHEMBL10776435 | 0.71 | ALDH1A1 (0.52) | TSHRALDH1A1AOC3NPC1RAB9A | |
| SCHEMBL3247641 | 0.71 | TSHR (0.52) | TSHRALDH1A1AOC3NPC1RAB9A |
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-1871741-A2 | SUBSTITUTED AZETIDINONES | Daiamed, Inc. (US) | 2008-01-02 | — | — | EP | disclosed |
| WO-2006108039-A2 | SUBSTITUTED AZETIDINONES | DAIAMED, INC. (US) | 2006-10-12 | — | — | WO | disclosed |