Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 4/20 | 0.48 |
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MME | P08473 | 3/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6747630 | 1.00 | TACR1 (0.48) | TACR1CTSSCTSKCYP1A2CYP2C9 | |
| SCHEMBL6190336 | 0.82 | MME (0.54) | CTSSCTSKMMEALDH1A1LMNA | |
| SCHEMBL6194235 | 0.82 | MME (0.54) | CTSSCTSKMMEALDH1A1LMNA | |
| SCHEMBL242242 | 0.80 | TACR1 (0.71) | TACR1CTSSCTSKCYP2C9CYP2C19 | |
| SCHEMBL12453492 | 0.80 | TACR1 (0.59) | TACR1CTSSCTSKALDH1A1LMNA | |
| SCHEMBL28683018 | 0.80 | CYP1A2 (0.48) | CYP1A2CYP2C9CYP2C19MMEALDH1A1 | |
| SCHEMBL242241 | 0.80 | TACR1 (0.71) | TACR1CTSSCTSKCYP2C9CYP2C19 | |
| SCHEMBL25669503 | 0.80 | TACR1 (0.59) | TACR1CTSSCTSKALDH1A1LMNA | |
| SCHEMBL8910127 | 0.79 | CYP1A2 (0.50) | CYP1A2CYP2C9CYP2C19MMEALDH1A1 | |
| Acetyl Tyrosine Ethyl Ester SCHEMBL14370511 | 0.78 | TACR1 (0.58) | TACR1MMETSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1202096-C | 2-aminothiazoline derivatives and their use as no-synthase inhibitors | AVENTIS PHARMA SA (FR) | 2005-05-18 | — | — | CN | disclosed |
| CN-1444572-A | 2-aminothiazoline derivatives and their use as no-synthase inhibitors | AVENTIS PHARMA SA (FR) | 2003-09-24 | — | — | CN | disclosed |